A0A077ZJG8_TRITR Loading...

D-methionine transport system permease protein MetI

Part of the binding-protein-dependent transport system for D-methionine and the toxic methionine analog alpha-methyl-methionine. Probably responsible for the translocation of the substrate across the membrane.

AlphaFold DB , UniProt , Accession A0A077ZJG8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 199 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M90.3Very high95.8Very high39 Ų3955.1 Ų55.119%0.19227%0.27CS..  0-53043.5-172.7157.400111.9F3 V4 S5 L71 A74 I75 L78 A151 G152M1-F3 PolarHBondContact O-N 3.4Å; M1-V4 PolarHBondContact O-N 2.88Å; M1-V4 VanDerWaalsContact O-N 3.12Å; M1-S5 WeakPolarHBondContact O-CB 3.47Å; M1-S5 PolarHBondContact O-N 3.04Å; M1-S5 PolarHBondContact O-OG 3.35Å; M1-L71 HydrophobicContact CB-CD1 3.5Å; M1-L71 VanDerWaalsContact CB-CD1 3.5Å; M1-L71 HydrophobicContact CB-CG 4.44Å; M1-L71 HydrophobicContact CE-CD1 4.33Å; M1-L71 HydrophobicContact CG-CD1 3.61Å; M1-L71 HydrophobicContact SD-CD1 3.88Å; M1-A74 HydrophobicContact SD-CB 4.18Å; M1-I75 HydrophobicContact CB-CG1 4.14Å; M1-L78 HydrophobicContact CB-CD1 3.92Å; M1-L78 HydrophobicContact CG-CD1 4.22Å; M1-L78 HydrophobicContact SD-CD1 4.02Å; M1-A151 HydrophobicContact CE-CB 4.31Å; M1-A151 HydrophobicContact SD-CB 4.15Å; M1-G152 WeakPolarHBondContact CE-O 3.46Å
2T92.6Very high96Very high17 Ų1757.3 Ų57.310%0.10428%0.282CS..Hα-helixtrans-45.2-58-176.5-47.70000114.7V4 S5 G6 L136 L139 V140T2-V4 PolarHBondContact O-N 3.39Å; T2-S5 PolarHBondContact O-N 3.39Å; T2-G6 PolarHBondContact O-N 3.09Å; T2-L136 HydrophobicContact CG2-CD2 4.36Å; T2-L136 WeakPolarHBondContact CG2-O 3.19Å; T2-L139 HydrophobicContact CG2-CB 3.66Å; T2-V140 HydrophobicContact CG2-CG2 3.8Å
3F94.7Very high96.2Very high129 Ų12952.8 Ų52.857%0.56626%0.261SS*.Hα-helixtrans-65-39.6-179.2-68.8-76.4000113.5M1 G6 F7 L136 I185M1-F3 PolarHBondContact O-N 3.4Å; F3-G6 PolarHBondContact O-N 3.24Å; F3-F7 WeakPolarHBondContact O-CB 3.39Å; F3-F7 PolarHBondContact O-N 2.9Å; F3-L136 HydrophobicContact CD1-CD1 4.19Å; F3-L136 HydrophobicContact CD1-CD2 3.91Å; F3-L136 HydrophobicContact CE1-CD1 4.02Å; F3-L136 HydrophobicContact CE1-CD2 4.36Å; F3-I185 HydrophobicContact CZ-CG1 4.35Å
4V95.9Very high96.3Very high67 Ų6753 Ų5341%0.40626%0.263SS..Hα-helixtrans-65.9-47.5179.2-179.80000110.4M1 T2 G6 F7 F8 I75M1-V4 PolarHBondContact O-N 2.88Å; M1-V4 VanDerWaalsContact O-N 3.12Å; T2-V4 PolarHBondContact O-N 3.39Å; V4-G6 VanDerWaalsContact C-N 3.3Å; V4-G6 PolarHBondContact O-N 2.9Å; V4-F7 PolarHBondContact O-N 3.34Å; V4-F8 HydrophobicContact CG1-CD2 3.85Å; V4-F8 HydrophobicContact CG1-CE2 3.67Å; V4-F8 VanDerWaalsContact O-CD2 3.26Å; V4-F8 WeakPolarHBondContact O-CD2 3.42Å; V4-F8 PolarHBondContact O-N 3.08Å; V4-I75 HydrophobicContact CB-CD1 4.35Å; V4-I75 HydrophobicContact CG1-CD1 3.96Å; V4-I75 HydrophobicContact CG1-CG2 4.24Å
5S95.8Very high96.4Very high0 Ų054.6 Ų54.60%028%0.278CS..Hα-helixtrans-64.8-36.3176-63.50000112.1M1 T2 G9 I75 L78 T79M1-S5 WeakPolarHBondContact O-CB 3.47Å; M1-S5 PolarHBondContact O-N 3.04Å; M1-S5 PolarHBondContact O-OG 3.35Å; T2-S5 PolarHBondContact O-N 3.39Å; S5-G9 WeakPolarHBondContact O-CA 3.49Å; S5-G9 PolarHBondContact O-N 2.95Å; S5-I75 WeakPolarHBondContact OG-CA 3.48Å; S5-I75 PolarHBondContact OG-O 3.45Å; S5-L78 VanDerWaalsContact OG-CB 3.25Å; S5-L78 WeakPolarHBondContact OG-CB 3.12Å; S5-T79 WeakPolarHBondContact CA-OG1 3.33Å; S5-T79 PolarHBondContact O-OG1 3.27Å
6G96.9Very high96.5Very high3 Ų353.7 Ų53.73%0.03128%0.276CS..Hα-helixtrans-61.6-48.5173.100000111.6T2 F3 V4 G9 F10T2-G6 PolarHBondContact O-N 3.09Å; F3-G6 PolarHBondContact O-N 3.24Å; V4-G6 VanDerWaalsContact C-N 3.3Å; V4-G6 PolarHBondContact O-N 2.9Å; G6-G9 CarbonylContact O-C 3.58Å; G6-G9 PolarHBondContact O-N 3.5Å; G6-F10 WeakPolarHBondContact O-CD2 3.45Å; G6-F10 PolarHBondContact O-N 3.39Å
7F97.3Very high96.6Very high130 Ų13050.5 Ų50.557%0.5726%0.26SS*.Hα-helixtrans-56.2-55.8176.2173.4-98.8000111.9F3 V4 G9 F10 V11F3-F7 WeakPolarHBondContact O-CB 3.39Å; F3-F7 PolarHBondContact O-N 2.9Å; V4-F7 PolarHBondContact O-N 3.34Å; F7-G9 VanDerWaalsContact C-N 3.26Å; F7-G9 PolarHBondContact O-N 3.41Å; F7-F10 PolarHBondContact O-N 3.16Å; F7-F10 VanDerWaalsContact O-N 3.09Å; F7-V11 HydrophobicContact CD1-CG2 4.34Å; F7-V11 HydrophobicContact CE1-CG2 3.93Å; F7-V11 HydrophobicContact CE2-CG2 4.25Å; F7-V11 HydrophobicContact CZ-CG2 3.88Å; F7-V11 WeakPolarHBondContact O-CG2 3.35Å; F7-V11 PolarHBondContact O-N 3.45Å
8F97.6Very high96.7Very high101 Ų10148.9 Ų48.944%0.44325%0.253SS..Hα-helixtrans-63.7-34.7177.9-72.9-65.7000112.5V4 F10 V11 I12 I75 T79V4-F8 HydrophobicContact CG1-CD2 3.85Å; V4-F8 HydrophobicContact CG1-CE2 3.67Å; V4-F8 VanDerWaalsContact O-CD2 3.26Å; V4-F8 WeakPolarHBondContact O-CD2 3.42Å; V4-F8 PolarHBondContact O-N 3.08Å; F8-F10 VanDerWaalsContact C-N 3.3Å; F8-F10 PolarHBondContact O-N 3.37Å; F8-V11 PolarHBondContact O-N 2.98Å; F8-I12 WeakPolarHBondContact O-CG1 3.5Å; F8-I12 PolarHBondContact O-N 2.85Å; F8-I12 VanDerWaalsContact O-N 3.15Å; F8-I75 HydrophobicContact CD2-CG2 4.49Å; F8-T79 HydrophobicContact CB-CG2 3.61Å
9G97.7Very high96.8Very high0 Ų049.8 Ų49.80%026%0.258CS..Hα-helixtrans-58.5-42.8172.800000111.4S5 G6 F7 I12 G13 I86S5-G9 WeakPolarHBondContact O-CA 3.49Å; S5-G9 PolarHBondContact O-N 2.95Å; G6-G9 CarbonylContact O-C 3.58Å; G6-G9 PolarHBondContact O-N 3.5Å; F7-G9 VanDerWaalsContact C-N 3.26Å; F7-G9 PolarHBondContact O-N 3.41Å; G9-I12 PolarHBondContact O-N 3.06Å; G9-G13 WeakPolarHBondContact O-CA 3.47Å; G9-G13 PolarHBondContact O-N 2.92Å; G9-I86 WeakPolarHBondContact O-CD1 3.47Å
10F97.5Very high96.8Very high40 Ų4047.4 Ų47.418%0.17525%0.245CC..Hα-helixtrans-70.3-39.6176.1-95.3-86000112.8G6 F7 F8 I12 G13 L14 I86 A132 T135G6-F10 WeakPolarHBondContact O-CD2 3.45Å; G6-F10 PolarHBondContact O-N 3.39Å; F7-F10 PolarHBondContact O-N 3.16Å; F7-F10 VanDerWaalsContact O-N 3.09Å; F8-F10 VanDerWaalsContact C-N 3.3Å; F8-F10 PolarHBondContact O-N 3.37Å; F10-I12 PolarHBondContact O-N 3.24Å; F10-G13 PolarHBondContact O-N 3.46Å; F10-L14 WeakPolarHBondContact O-CB 3.48Å; F10-L14 PolarHBondContact O-N 3.36Å; F10-I86 HydrophobicContact CD1-CG2 3.82Å; F10-I86 HydrophobicContact CD2-CD1 3.73Å; F10-I86 HydrophobicContact CD2-CG1 4.28Å; F10-I86 HydrophobicContact CD2-CG2 4.38Å; F10-I86 HydrophobicContact CE1-CG2 3.61Å; F10-I86 HydrophobicContact CE2-CD1 3.81Å; F10-I86 HydrophobicContact CE2-CG1 3.88Å; F10-I86 HydrophobicContact CE2-CG2 4.16Å; F10-I86 HydrophobicContact CG-CD1 4.28Å; F10-I86 HydrophobicContact CG-CG2 4.18Å; F10-I86 HydrophobicContact CZ-CD1 4.45Å; F10-I86 HydrophobicContact CZ-CG1 4.12Å; F10-I86 HydrophobicContact CZ-CG2 3.74Å; F10-A132 HydrophobicContact CD2-CB 4.47Å; F10-A132 HydrophobicContact CE1-CB 4.07Å; F10-A132 VanDerWaalsContact CE2-CA 3.41Å; F10-A132 HydrophobicContact CE2-CB 3.62Å; F10-A132 HydrophobicContact CZ-CB 3.41Å; F10-A132 VanDerWaalsContact CZ-CB 3.41Å; F10-T135 HydrophobicContact CE2-CG2 4.08Å
11V97.9Very high96.9Very high80 Ų8045.2 Ų45.249%0.48523%0.234SC..Hα-helixtrans-56.6-35.3175.9170.20000111.4F7 F8 P15F7-V11 HydrophobicContact CD1-CG2 4.34Å; F7-V11 HydrophobicContact CE1-CG2 3.93Å; F7-V11 HydrophobicContact CE2-CG2 4.25Å; F7-V11 HydrophobicContact CZ-CG2 3.88Å; F7-V11 WeakPolarHBondContact O-CG2 3.35Å; F7-V11 PolarHBondContact O-N 3.45Å; F8-V11 PolarHBondContact O-N 2.98Å; V11-P15 WeakPolarHBondContact O-CD 3.46Å; V11-P15 VanDerWaalsContact O-CG 3.27Å; V11-P15 WeakPolarHBondContact O-CG 3.3Å
12I98Very high97.2Very high81 Ų8143.9 Ų43.942%0.41523%0.228SC..Hα-helixtrans-89.3-49.4177.4-60.1169.9000111.2F8 G9 F10 P15 V16 T79 A83F8-I12 WeakPolarHBondContact O-CG1 3.5Å; F8-I12 PolarHBondContact O-N 2.85Å; F8-I12 VanDerWaalsContact O-N 3.15Å; G9-I12 PolarHBondContact O-N 3.06Å; F10-I12 PolarHBondContact O-N 3.24Å; I12-P15 WeakPolarHBondContact O-CD 3.44Å; I12-V16 HydrophobicContact CG2-CG2 4.47Å; I12-V16 VanDerWaalsContact O-CG2 3.25Å; I12-V16 WeakPolarHBondContact O-CG2 3.44Å; I12-V16 PolarHBondContact O-N 2.91Å; I12-T79 HydrophobicContact CD1-CG2 3.94Å; I12-A83 HydrophobicContact CB-CB 3.91Å; I12-A83 HydrophobicContact CG2-CB 3.82Å
13G98.4Very high97.4Very high0 Ų043.3 Ų43.30%022%0.224CC..Hα-helixtrans-68.3-37.3-171.700000113.5G9 F10 V16 G17 A83 A87G9-G13 WeakPolarHBondContact O-CA 3.47Å; G9-G13 PolarHBondContact O-N 2.92Å; F10-G13 PolarHBondContact O-N 3.46Å; G13-V16 PolarHBondContact O-N 2.68Å; G13-G17 PolarHBondContact O-N 2.88Å; G13-A83 WeakPolarHBondContact CA-O 3.46Å; G13-A87 VanDerWaalsContact O-CA 3.27Å; G13-A87 WeakPolarHBondContact O-CA 3.25Å; G13-A87 WeakPolarHBondContact O-CB 3.42Å
14L98Very high97.4Very high55 Ų5541 Ų4129%0.28821%0.212SC..Hα-helixtrans-64.3-52.2179.6177.772.9000111.7F10 V16 G17 V18 V90 L121 L128F10-L14 WeakPolarHBondContact O-CB 3.48Å; F10-L14 PolarHBondContact O-N 3.36Å; L14-V16 VanDerWaalsContact C-N 3.33Å; L14-V16 PolarHBondContact O-N 3.5Å; L14-G17 PolarHBondContact O-N 2.74Å; L14-V18 HydrophobicContact CD1-CG2 4.49Å; L14-V18 VanDerWaalsContact O-CG2 3.31Å; L14-V18 WeakPolarHBondContact O-CG2 3.33Å; L14-V18 PolarHBondContact O-N 2.93Å; L14-V90 HydrophobicContact CD1-CG1 3.87Å; L14-V90 HydrophobicContact CD1-CG2 3.88Å; L14-L121 HydrophobicContact CD1-CD2 4.25Å; L14-L128 HydrophobicContact CD1-CD1 4.31Å; L14-L128 HydrophobicContact CD1-CD2 4.01Å
15P97.9Very high97.3Very high77 Ų7741.6 Ų41.650%0.522%0.217SC..Hα-helixtrans-57.5-41.5173.1-27.535.7000113.8V11 I12 V18 L19V11-P15 WeakPolarHBondContact O-CD 3.46Å; V11-P15 VanDerWaalsContact O-CG 3.27Å; V11-P15 WeakPolarHBondContact O-CG 3.3Å; I12-P15 WeakPolarHBondContact O-CD 3.44Å; P15-V18 PolarHBondContact O-N 3.05Å; P15-L19 VanDerWaalsContact O-CB 3.31Å; P15-L19 WeakPolarHBondContact O-CB 3.48Å; P15-L19 PolarHBondContact O-N 3.49Å
16V98.2Very high96.9Very high40 Ų4045.2 Ų45.224%0.24225%0.254CS..Hα-helixtrans-66.8-40.2179.2175.90000111.3I12 G13 L14 L19 L20 V38 V42 A87I12-V16 HydrophobicContact CG2-CG2 4.47Å; I12-V16 VanDerWaalsContact O-CG2 3.25Å; I12-V16 WeakPolarHBondContact O-CG2 3.44Å; I12-V16 PolarHBondContact O-N 2.91Å; G13-V16 PolarHBondContact O-N 2.68Å; L14-V16 VanDerWaalsContact C-N 3.33Å; L14-V16 PolarHBondContact O-N 3.5Å; V16-L19 WeakPolarHBondContact O-CB 3.48Å; V16-L19 PolarHBondContact O-N 2.98Å; V16-L20 HydrophobicContact CG1-CD1 4.41Å; V16-L20 WeakPolarHBondContact O-CG 3.28Å; V16-L20 PolarHBondContact O-N 3.32Å; V16-V38 HydrophobicContact CG1-CG1 3.89Å; V16-V42 HydrophobicContact CG1-CG2 3.85Å; V16-A87 HydrophobicContact CB-CB 3.96Å; V16-A87 HydrophobicContact CG1-CB 3.76Å
17G98.3Very high96.7Very high0 Ų046.8 Ų46.80%026%0.261CS..Hα-helixtrans-66.1-41.7176.500000112.9G13 L14 L19 L20 Y21 A87G13-G17 PolarHBondContact O-N 2.88Å; L14-G17 PolarHBondContact O-N 2.74Å; G17-L19 VanDerWaalsContact C-N 3.34Å; G17-L20 PolarHBondContact O-N 3.25Å; G17-Y21 PolarHBondContact O-N 3.16Å; G17-A87 WeakPolarHBondContact CA-O 2.96Å
18V97.9Very high96.1Very high22 Ų2241.2 Ų41.213%0.13324%0.237CC..Hα-helixtrans-61.7-43.7171.6172.10000110.6L14 P15 L20 Y21 V22 V90 L94 V116 L121L14-V18 HydrophobicContact CD1-CG2 4.49Å; L14-V18 VanDerWaalsContact O-CG2 3.31Å; L14-V18 WeakPolarHBondContact O-CG2 3.33Å; L14-V18 PolarHBondContact O-N 2.93Å; P15-V18 PolarHBondContact O-N 3.05Å; V18-L20 PolarHBondContact O-N 3.02Å; V18-Y21 PolarHBondContact O-N 2.95Å; V18-V22 HydrophobicContact CG1-CG1 4.32Å; V18-V22 WeakPolarHBondContact O-CG1 3.25Å; V18-V22 WeakPolarHBondContact O-CG2 3.39Å; V18-V22 PolarHBondContact O-N 2.97Å; V18-V90 HydrophobicContact CG2-CG1 4.24Å; V18-L94 HydrophobicContact CG2-CD1 4.02Å; V18-V116 HydrophobicContact CG1-CG1 3.62Å; V18-V116 HydrophobicContact CG1-CG2 4.31Å; V18-L121 HydrophobicContact CG2-CD2 3.91Å
19L97.9Very high95.9Very high66 Ų6640.9 Ų40.935%0.34624%0.239SC..Hα-helixtrans-60.4-45177-178.565.7000111.6P15 V16 G17 Y21 T23 L34 V38P15-L19 VanDerWaalsContact O-CB 3.31Å; P15-L19 WeakPolarHBondContact O-CB 3.48Å; P15-L19 PolarHBondContact O-N 3.49Å; V16-L19 WeakPolarHBondContact O-CB 3.48Å; V16-L19 PolarHBondContact O-N 2.98Å; G17-L19 VanDerWaalsContact C-N 3.34Å; L19-Y21 VanDerWaalsContact C-N 3.33Å; L19-Y21 PolarHBondContact O-N 3.45Å; L19-T23 HydrophobicContact CD1-CG2 3.8Å; L19-T23 HydrophobicContact CG-CG2 4.36Å; L19-T23 WeakPolarHBondContact O-CB 3.45Å; L19-T23 VanDerWaalsContact O-CG2 3.24Å; L19-T23 WeakPolarHBondContact O-CG2 3.47Å; L19-T23 PolarHBondContact O-N 3.01Å; L19-T23 VanDerWaalsContact O-N 3.1Å; L19-T23 PolarHBondContact O-OG1 3.15Å; L19-L34 HydrophobicContact CD1-CD2 4.37Å; L19-V38 HydrophobicContact CD2-CG2 4.17Å
20L98Very high95.6Very high0 Ų043.8 Ų43.80%026%0.263CS..Hα-helixtrans-58.2-45.8175.1-78.1171.3000111.4V16 G17 V18 T23 R24 Y35 V38 V42 A87 E91V16-L20 HydrophobicContact CG1-CD1 4.41Å; V16-L20 WeakPolarHBondContact O-CG 3.28Å; V16-L20 PolarHBondContact O-N 3.32Å; G17-L20 PolarHBondContact O-N 3.25Å; V18-L20 PolarHBondContact O-N 3.02Å; L20-T23 PolarHBondContact O-OG1 3.02Å; L20-R24 PolarHBondContact O-N 3.34Å; L20-Y35 HydrophobicContact CB-CE2 4.49Å; L20-Y35 HydrophobicContact CD2-CD2 4.09Å; L20-Y35 HydrophobicContact CD2-CE2 4.09Å; L20-Y35 VanDerWaalsContact O-CD2 3.25Å; L20-Y35 WeakPolarHBondContact O-CD2 3.27Å; L20-Y35 WeakPolarHBondContact O-CE2 3.41Å; L20-V38 HydrophobicContact CD2-CB 3.9Å; L20-V38 HydrophobicContact CD2-CG1 3.67Å; L20-V38 HydrophobicContact CG-CG1 3.92Å; L20-V42 HydrophobicContact CD1-CG2 4.19Å; L20-A87 HydrophobicContact CD1-CB 4.39Å; L20-E91 HydrophobicContact CB-CB 4.27Å; L20-E91 HydrophobicContact CB-CG 4.11Å
21Y97.5Very high95.5Very high2 Ų245.4 Ų45.41%0.00827%0.273CS..Hα-helixtrans-61.1-55.8177.8176.2-92.5000112.1G17 V18 L19 T23 R24 Q27 I28 L94 L95 I102 L120G17-Y21 PolarHBondContact O-N 3.16Å; V18-Y21 PolarHBondContact O-N 2.95Å; L19-Y21 VanDerWaalsContact C-N 3.33Å; L19-Y21 PolarHBondContact O-N 3.45Å; Y21-T23 VanDerWaalsContact C-N 3.26Å; Y21-T23 PolarHBondContact O-N 3.13Å; Y21-R24 VanDerWaalsContact O-CB 3.31Å; Y21-R24 WeakPolarHBondContact O-CB 3.34Å; Y21-R24 PolarHBondContact O-N 2.91Å; Y21-Q27 VanDerWaalsContact O-CB 3.27Å; Y21-Q27 WeakPolarHBondContact O-CB 3.43Å; Y21-Q27 WeakPolarHBondContact O-CG 3.24Å; Y21-Q27 PolarHBondContact OH-OE1 2.88Å; Y21-I28 HydrophobicContact CE1-CD1 4.45Å; Y21-L94 HydrophobicContact CD1-CB 4.26Å; Y21-L94 HydrophobicContact CD1-CD1 4.37Å; Y21-L94 HydrophobicContact CD2-CB 3.38Å; Y21-L94 HydrophobicContact CD2-CD1 4.49Å; Y21-L94 HydrophobicContact CE2-CB 3.7Å; Y21-L94 WeakPolarHBondContact CE2-O 3.26Å; Y21-L94 HydrophobicContact CG-CB 3.66Å; Y21-L94 HydrophobicContact CG-CD1 3.95Å; Y21-L94 HydrophobicContact CG-CG 4.45Å; Y21-L95 HydrophobicContact CD2-CD2 4.01Å; Y21-L95 HydrophobicContact CD2-CG 4Å; Y21-L95 HydrophobicContact CE2-CD2 3.88Å; Y21-L95 HydrophobicContact CE2-CG 4.14Å; Y21-I102 WeakPolarHBondContact OH-CD1 3.41Å; Y21-L120 HydrophobicContact CD1-CD1 4Å; Y21-L120 HydrophobicContact CE1-CD1 3.41Å; Y21-L120 VanDerWaalsContact CE1-CD1 3.41Å; Y21-L120 HydrophobicContact CE1-CD2 4.25Å; Y21-L120 HydrophobicContact CE1-CG 4.49Å
22V96.5Very high95.4Very high12 Ų1243.7 Ų43.77%0.07327%0.267CS..Hα-helixtrans-67.6-26.5-172.7-59.30000113.2V18 I28 I29 V116V18-V22 HydrophobicContact CG1-CG1 4.32Å; V18-V22 WeakPolarHBondContact O-CG1 3.25Å; V18-V22 WeakPolarHBondContact O-CG2 3.39Å; V18-V22 PolarHBondContact O-N 2.97Å; V22-I28 HydrophobicContact CG1-CD1 4.49Å; V22-I29 CarbonylContact O-C 3.42Å; V22-I29 WeakPolarHBondContact O-CA 3.35Å; V22-I29 PolarHBondContact O-N 3.41Å; V22-V116 HydrophobicContact CG1-CG2 3.67Å
23T97.1Very high95.3Very high4 Ų447.7 Ų47.73%0.02528%0.282CS..Hα-helixtrans-88.7-9.8-179.658.90000113.7L19 L20 Y21 N31 L34L19-T23 HydrophobicContact CD1-CG2 3.8Å; L19-T23 HydrophobicContact CG-CG2 4.36Å; L19-T23 WeakPolarHBondContact O-CB 3.45Å; L19-T23 VanDerWaalsContact O-CG2 3.24Å; L19-T23 WeakPolarHBondContact O-CG2 3.47Å; L19-T23 PolarHBondContact O-N 3.01Å; L19-T23 VanDerWaalsContact O-N 3.1Å; L19-T23 PolarHBondContact O-OG1 3.15Å; L20-T23 PolarHBondContact O-OG1 3.02Å; Y21-T23 VanDerWaalsContact C-N 3.26Å; Y21-T23 PolarHBondContact O-N 3.13Å; T23-N31 CarbonylContact O-C 3.55Å; T23-N31 PolarHBondContact O-N 3.25Å; T23-L34 HydrophobicContact CG2-CD2 3.68Å; T23-L34 HydrophobicContact CG2-CG 4.1Å
24R95.9Very high95.3Very high82 Ų8250.9 Ų50.931%0.30930%0.298SS..SBendtrans-61146.4-179.5-168.9174.7175.9126.1-3.6111.2L20 Y21 G26 Q27 Y35 E91L20-R24 PolarHBondContact O-N 3.34Å; Y21-R24 VanDerWaalsContact O-CB 3.31Å; Y21-R24 WeakPolarHBondContact O-CB 3.34Å; Y21-R24 PolarHBondContact O-N 2.91Å; R24-G26 PolarHBondContact O-N 3.22Å; R24-Q27 HydrophobicContact CB-CB 4.33Å; R24-Q27 HydrophobicContact CB-CG 3.82Å; R24-Q27 HydrophobicContact CG-CG 4.48Å; R24-Q27 WeakPolarHBondContact O-CB 3.17Å; R24-Q27 PolarHBondContact O-N 3.2Å; R24-Y35 HydrophobicContact CB-CD2 3.99Å; R24-Y35 HydrophobicContact CB-CE2 3.99Å; R24-Y35 HydrophobicContact CG-CD2 4.35Å; R24-Y35 HydrophobicContact CG-CE1 4.49Å; R24-Y35 HydrophobicContact CG-CE2 3.99Å; R24-Y35 PolarHBondContact NH1-OH 3.37Å; R24-E91 IonicContact CZ-OE1 3.93Å; R24-E91 IonicContact NH1-OE1 2.82Å; R24-E91 PolarHBondContact NH1-OE1 3.37Å
25P92.1Very high95.3Very high79 Ų7949.9 Ų49.951%0.51329%0.291SS..THydrogen-bonded Turntrans-54.3132.3175.6-26.435.3000111.7Q27 A32P25-Q27 VanDerWaalsContact C-N 3.31Å; P25-A32 HydrophobicContact CG-CB 4.43Å
26G89Confident95.2Very high76 Ų7654.9 Ų54.978%0.78430%0.3SS*.THydrogen-bonded Turntrans83.5-4.4-177.100000115.4R24R24-G26 PolarHBondContact O-N 3.22Å
27Q91.3Very high95.2Very high36 Ų3656.5 Ų56.517%0.16831%0.31CS..SBendtrans-95-170.3179.5-63.8-64.1-15.600112.8Y21 R24 P25 I29 A30Y21-Q27 VanDerWaalsContact O-CB 3.27Å; Y21-Q27 WeakPolarHBondContact O-CB 3.43Å; Y21-Q27 WeakPolarHBondContact O-CG 3.24Å; Y21-Q27 PolarHBondContact OH-OE1 2.88Å; R24-Q27 HydrophobicContact CB-CB 4.33Å; R24-Q27 HydrophobicContact CB-CG 3.82Å; R24-Q27 HydrophobicContact CG-CG 4.48Å; R24-Q27 WeakPolarHBondContact O-CB 3.17Å; R24-Q27 PolarHBondContact O-N 3.2Å; P25-Q27 VanDerWaalsContact C-N 3.31Å; Q27-I29 PolarHBondContact O-N 2.67Å; Q27-A30 PolarHBondContact O-N 3.1Å
28I86.2Confident95.2Very high13 Ų1357.5 Ų57.57%0.06732%0.316CS..THydrogen-bonded Turntrans-61.5-42.5-162-54.8175.1000113.3Y21 V22 I102 R106 P112 I115 L120Y21-I28 HydrophobicContact CE1-CD1 4.45Å; V22-I28 HydrophobicContact CG1-CD1 4.49Å; I28-I102 HydrophobicContact CD1-CG2 4.3Å; I28-I102 HydrophobicContact CG1-CG2 4.12Å; I28-R106 VanDerWaalsContact C-NH2 3.34Å; I28-R106 PolarHBondContact O-NH2 3.08Å; I28-P112 HydrophobicContact CG2-CB 3.51Å; I28-P112 HydrophobicContact CG2-CG 3.81Å; I28-I115 HydrophobicContact CD1-CB 4.1Å; I28-I115 HydrophobicContact CD1-CG2 3.57Å; I28-I115 HydrophobicContact CG2-CD1 4.44Å; I28-L120 HydrophobicContact CD1-CD1 3.75Å
29I91.5Very high95.2Very high94 Ų9457.1 Ų57.148%0.48231%0.314SS..THydrogen-bonded Turntrans-128.854.1-177.4-44.4176.4000107.5V22 Q27 N31 P112V22-I29 CarbonylContact O-C 3.42Å; V22-I29 WeakPolarHBondContact O-CA 3.35Å; V22-I29 PolarHBondContact O-N 3.41Å; Q27-I29 PolarHBondContact O-N 2.67Å; I29-N31 PolarHBondContact O-N 3.03Å; I29-N31 VanDerWaalsContact O-N 3.08Å; I29-P112 HydrophobicContact CD1-CB 3.71Å; I29-P112 HydrophobicContact CD1-CG 4.34Å; I29-P112 HydrophobicContact CG1-CB 3.85Å; I29-P112 HydrophobicContact CG1-CG 4.17Å
30A91.7Very high95.2Very high61 Ų6156.2 Ų56.250%0.50432%0.317SS..  trans-50.7117.5-172.700000111.7Q27Q27-A30 PolarHBondContact O-N 3.1Å
31N96.3Very high95.2Very high73 Ų7360.4 Ų60.439%0.3934%0.338SS..  trans-14390.2177-175.6-26.9000108.2T23 I29 K33 L34 Y35T23-N31 CarbonylContact O-C 3.55Å; T23-N31 PolarHBondContact O-N 3.25Å; I29-N31 PolarHBondContact O-N 3.03Å; I29-N31 VanDerWaalsContact O-N 3.08Å; N31-K33 PolarHBondContact O-N 3.33Å; N31-K33 PolarHBondContact OD1-N 2.87Å; N31-L34 HydrophobicContact CB-CB 4.01Å; N31-L34 VanDerWaalsContact CG-CB 3.49Å; N31-L34 PolarHBondContact O-N 3.21Å; N31-L34 PolarHBondContact OD1-N 3.29Å; N31-Y35 WeakPolarHBondContact O-CB 3.34Å; N31-Y35 PolarHBondContact O-N 3.27Å
32A95Very high95.3Very high44 Ų4460.7 Ų60.736%0.36434%0.34SS..Hα-helixtrans-58.6-34.3-174.200000112.9P25 R36P25-A32 HydrophobicContact CG-CB 4.43Å; A32-R36 WeakPolarHBondContact O-CB 3.31Å; A32-R36 WeakPolarHBondContact O-CD 3.43Å; A32-R36 WeakPolarHBondContact O-CG 3.46Å; A32-R36 PolarHBondContact O-N 2.87Å
33K96.8Very high95.3Very high166 Ų16662.9 Ų62.972%0.72235%0.351SS*.Hα-helixtrans-67.9-52.1178.3-172.5178.3-178.7-179.80110.5N31 Y35 R36 T37N31-K33 PolarHBondContact O-N 3.33Å; N31-K33 PolarHBondContact OD1-N 2.87Å; K33-Y35 PolarHBondContact O-N 3.25Å; K33-R36 PolarHBondContact O-N 3.47Å; K33-T37 PolarHBondContact O-N 3.47Å; K33-T37 PolarHBondContact O-OG1 3.1Å; K33-T37 VanDerWaalsContact O-OG1 3.1Å
34L97.2Very high95.3Very high67 Ų6767.7 Ų67.735%0.35138%0.376SS..Hα-helixtrans-60.8-45.9179.3-178.657.2000111.5L19 T23 N31 R36 T37 V38L19-L34 HydrophobicContact CD1-CD2 4.37Å; T23-L34 HydrophobicContact CG2-CD2 3.68Å; T23-L34 HydrophobicContact CG2-CG 4.1Å; N31-L34 HydrophobicContact CB-CB 4.01Å; N31-L34 VanDerWaalsContact CG-CB 3.49Å; N31-L34 PolarHBondContact O-N 3.21Å; N31-L34 PolarHBondContact OD1-N 3.29Å; L34-R36 PolarHBondContact O-N 3.24Å; L34-T37 PolarHBondContact O-N 2.93Å; L34-V38 HydrophobicContact CD1-CG2 3.84Å; L34-V38 HydrophobicContact CG-CG2 4.4Å; L34-V38 WeakPolarHBondContact O-CG2 3.46Å; L34-V38 PolarHBondContact O-N 3.47Å
35Y97.9Very high95.3Very high33 Ų3366.8 Ų66.813%0.12937%0.374CS..Hα-helixtrans-55-51.8175.2175.2-104000111.8L20 R24 N31 K33 T37 V38 S39 E91L20-Y35 HydrophobicContact CB-CE2 4.49Å; L20-Y35 HydrophobicContact CD2-CD2 4.09Å; L20-Y35 HydrophobicContact CD2-CE2 4.09Å; L20-Y35 VanDerWaalsContact O-CD2 3.25Å; L20-Y35 WeakPolarHBondContact O-CD2 3.27Å; L20-Y35 WeakPolarHBondContact O-CE2 3.41Å; R24-Y35 HydrophobicContact CB-CD2 3.99Å; R24-Y35 HydrophobicContact CB-CE2 3.99Å; R24-Y35 HydrophobicContact CG-CD2 4.35Å; R24-Y35 HydrophobicContact CG-CE1 4.49Å; R24-Y35 HydrophobicContact CG-CE2 3.99Å; R24-Y35 PolarHBondContact NH1-OH 3.37Å; N31-Y35 WeakPolarHBondContact O-CB 3.34Å; N31-Y35 PolarHBondContact O-N 3.27Å; K33-Y35 PolarHBondContact O-N 3.25Å; Y35-T37 VanDerWaalsContact C-N 3.35Å; Y35-T37 PolarHBondContact O-N 3.36Å; Y35-V38 PolarHBondContact O-N 3.49Å; Y35-S39 WeakPolarHBondContact O-CB 3.33Å; Y35-S39 PolarHBondContact O-N 3.32Å; Y35-E91 WeakPolarHBondContact CE2-OE1 3.14Å; Y35-E91 PolarHBondContact OH-OE1 3.31Å
36R97.7Very high95.5Very high182 Ų18267.2 Ų67.269%0.68737%0.365SS*.Hα-helixtrans-60.9-42.5-179.6-75.1173.5-175.9-175.62.3111.8A32 K33 L34 A40A32-R36 WeakPolarHBondContact O-CB 3.31Å; A32-R36 WeakPolarHBondContact O-CD 3.43Å; A32-R36 WeakPolarHBondContact O-CG 3.46Å; A32-R36 PolarHBondContact O-N 2.87Å; K33-R36 PolarHBondContact O-N 3.47Å; L34-R36 PolarHBondContact O-N 3.24Å; R36-A40 VanDerWaalsContact O-CB 3.23Å; R36-A40 WeakPolarHBondContact O-CB 3.27Å; R36-A40 PolarHBondContact O-N 3.23Å
37T98Very high95.8Very high74 Ų7468.2 Ų68.245%0.45436%0.36SS..Hα-helixtrans-64.7-51.1178.6-59.60000112K33 L34 Y35 S39 A40 I41K33-T37 PolarHBondContact O-N 3.47Å; K33-T37 PolarHBondContact O-OG1 3.1Å; K33-T37 VanDerWaalsContact O-OG1 3.1Å; L34-T37 PolarHBondContact O-N 2.93Å; Y35-T37 VanDerWaalsContact C-N 3.35Å; Y35-T37 PolarHBondContact O-N 3.36Å; T37-S39 PolarHBondContact O-N 2.9Å; T37-A40 PolarHBondContact O-N 3.32Å; T37-I41 HydrophobicContact CG2-CD1 4.25Å; T37-I41 WeakPolarHBondContact O-CG1 3.15Å; T37-I41 PolarHBondContact O-N 2.98Å; T37-I41 VanDerWaalsContact O-N 3.09Å
38V98Very high96.1Very high22 Ų2268.7 Ų68.713%0.13336%0.364CS..Hα-helixtrans-65.3-42-179.8179.60000110.5V16 L19 L20 L34 Y35 A40 I41 V42V16-V38 HydrophobicContact CG1-CG1 3.89Å; L19-V38 HydrophobicContact CD2-CG2 4.17Å; L20-V38 HydrophobicContact CD2-CB 3.9Å; L20-V38 HydrophobicContact CD2-CG1 3.67Å; L20-V38 HydrophobicContact CG-CG1 3.92Å; L34-V38 HydrophobicContact CD1-CG2 3.84Å; L34-V38 HydrophobicContact CG-CG2 4.4Å; L34-V38 WeakPolarHBondContact O-CG2 3.46Å; L34-V38 PolarHBondContact O-N 3.47Å; Y35-V38 PolarHBondContact O-N 3.49Å; V38-A40 VanDerWaalsContact C-N 3.34Å; V38-A40 PolarHBondContact O-N 3.47Å; V38-I41 PolarHBondContact O-N 3.3Å; V38-V42 HydrophobicContact CG1-CG2 4.47Å; V38-V42 WeakPolarHBondContact O-CG2 3.31Å; V38-V42 PolarHBondContact O-N 2.94Å
39S98.1Very high96.5Very high13 Ų1372.1 Ų72.19%0.09139%0.387CS..Hα-helixtrans-62.7-40.7178-1720000111.5Y35 T37 V42 N43 R88Y35-S39 WeakPolarHBondContact O-CB 3.33Å; Y35-S39 PolarHBondContact O-N 3.32Å; T37-S39 PolarHBondContact O-N 2.9Å; S39-V42 PolarHBondContact O-N 2.98Å; S39-N43 WeakPolarHBondContact O-CB 3.23Å; S39-N43 PolarHBondContact O-N 3.45Å; S39-N43 PolarHBondContact O-ND2 3.3Å; S39-R88 PolarHBondContact OG-NH2 3.04Å
40A98.1Very high96.7Very high48 Ų4868 Ų6840%0.39737%0.366SS..Hα-helixtrans-61-48.5174.200000111.7R36 T37 V38 V42 N43 I44R36-A40 VanDerWaalsContact O-CB 3.23Å; R36-A40 WeakPolarHBondContact O-CB 3.27Å; R36-A40 PolarHBondContact O-N 3.23Å; T37-A40 PolarHBondContact O-N 3.32Å; V38-A40 VanDerWaalsContact C-N 3.34Å; V38-A40 PolarHBondContact O-N 3.47Å; A40-V42 PolarHBondContact O-N 2.84Å; A40-N43 PolarHBondContact O-N 3.46Å; A40-I44 VanDerWaalsContact O-CG1 3.27Å; A40-I44 WeakPolarHBondContact O-CG1 3.14Å; A40-I44 PolarHBondContact O-N 3.38Å
41I97.7Very high96.8Very high88 Ų8869.1 Ų69.145%0.45136%0.362SS..Hα-helixtrans-58.4-49.2177.3-65.8166.4000110.6T37 V38 N43 I44 F45T37-I41 HydrophobicContact CG2-CD1 4.25Å; T37-I41 WeakPolarHBondContact O-CG1 3.15Å; T37-I41 PolarHBondContact O-N 2.98Å; T37-I41 VanDerWaalsContact O-N 3.09Å; V38-I41 PolarHBondContact O-N 3.3Å; I41-N43 VanDerWaalsContact C-N 3.3Å; I41-N43 PolarHBondContact O-N 3.29Å; I41-I44 PolarHBondContact O-N 3.4Å; I41-F45 HydrophobicContact CG2-CD2 4.13Å; I41-F45 HydrophobicContact CG2-CE2 4.13Å; I41-F45 WeakPolarHBondContact O-CD2 3.17Å; I41-F45 PolarHBondContact O-N 3.15Å
42V98.2Very high96.8Very high8 Ų870.4 Ų70.45%0.04837%0.368CS..Hα-helixtrans-58.5-43.3178165.80000111.3V16 L20 V38 S39 A40 R46 P84 A87V16-V42 HydrophobicContact CG1-CG2 3.85Å; L20-V42 HydrophobicContact CD1-CG2 4.19Å; V38-V42 HydrophobicContact CG1-CG2 4.47Å; V38-V42 WeakPolarHBondContact O-CG2 3.31Å; V38-V42 PolarHBondContact O-N 2.94Å; S39-V42 PolarHBondContact O-N 2.98Å; A40-V42 PolarHBondContact O-N 2.84Å; V42-R46 HydrophobicContact CG1-CG 4.43Å; V42-R46 WeakPolarHBondContact O-CB 3.33Å; V42-R46 VanDerWaalsContact O-CG 3.24Å; V42-R46 WeakPolarHBondContact O-CG 3.46Å; V42-R46 PolarHBondContact O-N 3.31Å; V42-P84 HydrophobicContact CG1-CB 4.06Å; V42-P84 WeakPolarHBondContact CG1-O 3.46Å; V42-A87 HydrophobicContact CG2-CB 4.44Å
43N97.7Very high96.9Very high58 Ų5868.4 Ų68.431%0.3135%0.351SS..Hα-helixtrans-68.4-38.1180-68.8-20.4000112.3S39 A40 I41 F45 R46 S47 R88S39-N43 WeakPolarHBondContact O-CB 3.23Å; S39-N43 PolarHBondContact O-N 3.45Å; S39-N43 PolarHBondContact O-ND2 3.3Å; A40-N43 PolarHBondContact O-N 3.46Å; I41-N43 VanDerWaalsContact C-N 3.3Å; I41-N43 PolarHBondContact O-N 3.29Å; N43-F45 PolarHBondContact O-N 3.47Å; N43-R46 PolarHBondContact O-N 2.81Å; N43-R46 PolarHBondContact OD1-NH1 3.45Å; N43-S47 WeakPolarHBondContact O-CB 3.49Å; N43-S47 PolarHBondContact O-N 2.86Å; N43-S47 PolarHBondContact O-OG 2.91Å; N43-R88 PolarHBondContact OD1-NH2 3.49Å
44I96.9Very high96.8Very high105 Ų10561 Ų6154%0.53832%0.32SS..Hα-helixtrans-56.6-52.7175.1-69.5166.7000110.4A40 I41 R46 S47 I48A40-I44 VanDerWaalsContact O-CG1 3.27Å; A40-I44 WeakPolarHBondContact O-CG1 3.14Å; A40-I44 PolarHBondContact O-N 3.38Å; I41-I44 PolarHBondContact O-N 3.4Å; I44-R46 PolarHBondContact O-N 3.26Å; I44-S47 PolarHBondContact O-N 2.99Å; I44-I48 WeakPolarHBondContact O-CG1 3.49Å; I44-I48 PolarHBondContact O-N 3.36Å
45F96.1Very high96.7Very high63 Ų6361.4 Ų61.428%0.27632%0.324SS..Hα-helixtrans-65.9-35.4-180-79.9-89.1000113I41 N43 S47 I48 L53 W56 V80 P84I41-F45 HydrophobicContact CG2-CD2 4.13Å; I41-F45 HydrophobicContact CG2-CE2 4.13Å; I41-F45 WeakPolarHBondContact O-CD2 3.17Å; I41-F45 PolarHBondContact O-N 3.15Å; N43-F45 PolarHBondContact O-N 3.47Å; F45-S47 VanDerWaalsContact C-N 3.28Å; F45-S47 PolarHBondContact O-N 3.23Å; F45-I48 PolarHBondContact O-N 3.46Å; F45-L53 HydrophobicContact CD1-CD1 4.24Å; F45-W56 HydrophobicContact CE1-CZ3 4.5Å; F45-V80 HydrophobicContact CD1-CG1 3.96Å; F45-V80 HydrophobicContact CE1-CG1 3.77Å; F45-P84 HydrophobicContact CB-CB 4.17Å; F45-P84 HydrophobicContact CB-CG 3.58Å; F45-P84 HydrophobicContact CG-CG 4.35Å
46R95.4Very high96.6Very high87 Ų8767.7 Ų67.733%0.32835%0.348SS..Hα-helixtrans-66.2-30.2175.3-73.4174.367.2-144.53113.2V42 N43 I44 I48 P84 F85V42-R46 HydrophobicContact CG1-CG 4.43Å; V42-R46 WeakPolarHBondContact O-CB 3.33Å; V42-R46 VanDerWaalsContact O-CG 3.24Å; V42-R46 WeakPolarHBondContact O-CG 3.46Å; V42-R46 PolarHBondContact O-N 3.31Å; N43-R46 PolarHBondContact O-N 2.81Å; N43-R46 PolarHBondContact OD1-NH1 3.45Å; I44-R46 PolarHBondContact O-N 3.26Å; R46-I48 VanDerWaalsContact C-N 3.32Å; R46-P84 HydrophobicContact CG-CB 3.61Å; R46-F85 HydrophobicContact CB-CE1 4.21Å; R46-F85 HydrophobicContact CB-CZ 4.11Å; R46-F85 HydrophobicContact CG-CD1 4.15Å; R46-F85 HydrophobicContact CG-CD2 4.38Å; R46-F85 HydrophobicContact CG-CE1 4.1Å; R46-F85 HydrophobicContact CG-CE2 4.33Å; R46-F85 HydrophobicContact CG-CG 4.27Å; R46-F85 HydrophobicContact CG-CZ 4.18Å
47S96.8Very high96.5Very high97 Ų9759.3 Ų59.368%0.67832%0.317SS*.Hα-helixtrans-77.3-16-179.2-69.80000113.4N43 I44 F45 P49N43-S47 WeakPolarHBondContact O-CB 3.49Å; N43-S47 PolarHBondContact O-N 2.86Å; N43-S47 PolarHBondContact O-OG 2.91Å; I44-S47 PolarHBondContact O-N 2.99Å; F45-S47 VanDerWaalsContact C-N 3.28Å; F45-S47 PolarHBondContact O-N 3.23Å; S47-P49 WeakPolarHBondContact O-CD 3.27Å
48I96Very high96.3Very high47 Ų4759 Ų5924%0.24131%0.312CS..SBendtrans-81.8118.1178.4-57.8168.3000108.8I44 F45 R46 F50 I52 L53I44-I48 WeakPolarHBondContact O-CG1 3.49Å; I44-I48 PolarHBondContact O-N 3.36Å; F45-I48 PolarHBondContact O-N 3.46Å; R46-I48 VanDerWaalsContact C-N 3.32Å; I48-F50 PolarHBondContact O-N 2.73Å; I48-I52 HydrophobicContact CG2-CB 4.18Å; I48-I52 HydrophobicContact CG2-CG2 4.14Å; I48-L53 HydrophobicContact CB-CB 4.47Å; I48-L53 HydrophobicContact CD1-CD1 4.33Å; I48-L53 HydrophobicContact CG2-CB 3.75Å; I48-L53 HydrophobicContact CG2-CD1 4.4Å
49P96Very high96.1Very high85 Ų8562.1 Ų62.155%0.55233%0.332SS*.  trans-56.4136.4174.4-24.434.9000111.1S47 I51 I52 L53S47-P49 WeakPolarHBondContact O-CD 3.27Å; P49-I51 VanDerWaalsContact C-N 3.29Å; P49-I51 PolarHBondContact O-N 2.96Å; P49-I51 VanDerWaalsContact O-N 3.15Å; P49-I52 HydrophobicContact CB-CG1 4.25Å; P49-I52 WeakPolarHBondContact O-CA 3.32Å; P49-I52 WeakPolarHBondContact O-CB 3.49Å; P49-I52 PolarHBondContact O-N 3.35Å; P49-L53 PolarHBondContact O-N 3.35Å
50F95.4Very high96Very high8 Ų866.5 Ų66.54%0.03535%0.35CS..Hα-helixtrans-57-39.2-168.2179.6-99.5000113.9I48 I52 L53 L54 L78 Y142 M145I48-F50 PolarHBondContact O-N 2.73Å; F50-I52 VanDerWaalsContact C-N 3.29Å; F50-I52 PolarHBondContact O-N 2.95Å; F50-L53 HydrophobicContact CD2-CD2 4.43Å; F50-L53 WeakPolarHBondContact O-CB 3.16Å; F50-L53 PolarHBondContact O-N 3.01Å; F50-L54 HydrophobicContact CE1-CB 4.07Å; F50-L54 HydrophobicContact CE1-CD1 3.67Å; F50-L54 HydrophobicContact CZ-CB 4.12Å; F50-L54 HydrophobicContact CZ-CD1 3.87Å; F50-L54 VanDerWaalsContact O-CB 3.23Å; F50-L54 WeakPolarHBondContact O-CB 3.48Å; F50-L54 PolarHBondContact O-N 3.06Å; F50-L78 HydrophobicContact CE1-CD2 3.98Å; F50-L78 HydrophobicContact CE2-CD2 3.95Å; F50-L78 HydrophobicContact CE2-CG 4.48Å; F50-L78 HydrophobicContact CZ-CD2 3.35Å; F50-L78 HydrophobicContact CZ-CG 3.88Å; F50-Y142 HydrophobicContact CB-CD1 3.65Å; F50-Y142 HydrophobicContact CB-CD2 4.07Å; F50-Y142 HydrophobicContact CB-CE1 3.57Å; F50-Y142 HydrophobicContact CB-CE2 3.99Å; F50-Y142 HydrophobicContact CB-CG 3.91Å; F50-Y142 AromaticContact CD1-CD1 3.91Å; F50-Y142 HydrophobicContact CD1-CD1 3.91Å; F50-Y142 HydrophobicContact CD1-CD2 4.2Å; F50-Y142 AromaticContact CD1-CG 3.63Å; F50-Y142 HydrophobicContact CD1-CG 3.63Å; F50-Y142 HydrophobicContact CD2-CD1 4.3Å; F50-Y142 AromaticContact CD2-CD2 3.32Å; F50-Y142 HydrophobicContact CD2-CD2 3.32Å; F50-Y142 AromaticContact CD2-CE2 3.7Å; F50-Y142 HydrophobicContact CD2-CE2 3.7Å; F50-Y142 AromaticContact CD2-CG 3.66Å; F50-Y142 HydrophobicContact CD2-CG 3.66Å; F50-Y142 HydrophobicContact CE1-CG 4.1Å; F50-Y142 WeakPolarHBondContact CE1-O 3.36Å; F50-Y142 AromaticContact CE2-CD2 3.78Å; F50-Y142 HydrophobicContact CE2-CD2 3.78Å; F50-Y142 HydrophobicContact CE2-CG 4.12Å; F50-Y142 AromaticContact CG-CD1 3.66Å; F50-Y142 HydrophobicContact CG-CD1 3.66Å; F50-Y142 AromaticContact CG-CD2 3.56Å; F50-Y142 HydrophobicContact CG-CD2 3.56Å; F50-Y142 HydrophobicContact CG-CE1 4.05Å; F50-Y142 AromaticContact CG-CE2 3.95Å; F50-Y142 HydrophobicContact CG-CE2 3.95Å; F50-Y142 AromaticContact CG-CG 3.4Å; F50-Y142 HydrophobicContact CG-CG 3.4Å; F50-Y142 VanDerWaalsContact CG-CG 3.4Å; F50-Y142 HydrophobicContact CZ-CD2 4.4Å; F50-Y142 HydrophobicContact CZ-CG 4.33Å; F50-M145 HydrophobicContact CB-SD 4.18Å; F50-M145 HydrophobicContact CD1-CB 4.07Å; F50-M145 HydrophobicContact CD1-SD 3.85Å; F50-M145 HydrophobicContact CE1-CB 4.32Å; F50-M145 HydrophobicContact CG-SD 4.5Å
51I94.2Very high95.9Very high83 Ų8364.5 Ų64.543%0.42633%0.333SS..Hα-helixtrans-61.3-38177.3-166.4165.7000112.2P49 V55 M145P49-I51 VanDerWaalsContact C-N 3.29Å; P49-I51 PolarHBondContact O-N 2.96Å; P49-I51 VanDerWaalsContact O-N 3.15Å; I51-V55 WeakPolarHBondContact O-CG2 3.35Å; I51-V55 PolarHBondContact O-N 3.34Å; I51-M145 HydrophobicContact CB-SD 4.38Å
52I96.3Very high95.7Very high101 Ų10166.9 Ų66.952%0.51834%0.336SS..Hα-helixtrans-69.5-45.4176-57.5-59.9000110I48 P49 F50 L54 V55 W56I48-I52 HydrophobicContact CG2-CB 4.18Å; I48-I52 HydrophobicContact CG2-CG2 4.14Å; P49-I52 HydrophobicContact CB-CG1 4.25Å; P49-I52 WeakPolarHBondContact O-CA 3.32Å; P49-I52 WeakPolarHBondContact O-CB 3.49Å; P49-I52 PolarHBondContact O-N 3.35Å; F50-I52 VanDerWaalsContact C-N 3.29Å; F50-I52 PolarHBondContact O-N 2.95Å; I52-L54 VanDerWaalsContact C-N 3.3Å; I52-L54 PolarHBondContact O-N 3.23Å; I52-V55 PolarHBondContact O-N 3.35Å; I52-W56 WeakPolarHBondContact O-CB 3.25Å; I52-W56 PolarHBondContact O-N 2.94Å
53L96.3Very high95.6Very high2 Ų272.6 Ų72.61%0.0137%0.371CS..Hα-helixtrans-57-46.4176.1-17968000111F45 I48 P49 F50 V55 W56 M57 G81F45-L53 HydrophobicContact CD1-CD1 4.24Å; I48-L53 HydrophobicContact CB-CB 4.47Å; I48-L53 HydrophobicContact CD1-CD1 4.33Å; I48-L53 HydrophobicContact CG2-CB 3.75Å; I48-L53 HydrophobicContact CG2-CD1 4.4Å; P49-L53 PolarHBondContact O-N 3.35Å; F50-L53 HydrophobicContact CD2-CD2 4.43Å; F50-L53 WeakPolarHBondContact O-CB 3.16Å; F50-L53 PolarHBondContact O-N 3.01Å; L53-V55 PolarHBondContact O-N 3.28Å; L53-W56 HydrophobicContact CD1-CE3 4.03Å; L53-W56 HydrophobicContact CD1-CZ3 4.3Å; L53-W56 PolarHBondContact O-N 3.07Å; L53-M57 HydrophobicContact CD1-CG 4.03Å; L53-M57 HydrophobicContact CD1-SD 3.78Å; L53-M57 HydrophobicContact CD2-SD 4.37Å; L53-M57 HydrophobicContact CG-CG 4.31Å; L53-M57 HydrophobicContact CG-SD 3.81Å; L53-M57 VanDerWaalsContact O-CB 3.28Å; L53-M57 WeakPolarHBondContact O-CB 3.03Å; L53-M57 VanDerWaalsContact O-CG 3.23Å; L53-M57 WeakPolarHBondContact O-CG 3.31Å; L53-M57 PolarHBondContact O-N 3.35Å; L53-G81 VanDerWaalsContact CD2-CA 3.44Å
54L94.6Very high95.4Very high11 Ų1174.4 Ų74.46%0.05838%0.379CS..Hα-helixtrans-62.1-42.1-178167.6147.9000112.1F50 I52 P77 V149F50-L54 HydrophobicContact CE1-CB 4.07Å; F50-L54 HydrophobicContact CE1-CD1 3.67Å; F50-L54 HydrophobicContact CZ-CB 4.12Å; F50-L54 HydrophobicContact CZ-CD1 3.87Å; F50-L54 VanDerWaalsContact O-CB 3.23Å; F50-L54 WeakPolarHBondContact O-CB 3.48Å; F50-L54 PolarHBondContact O-N 3.06Å; I52-L54 VanDerWaalsContact C-N 3.3Å; I52-L54 PolarHBondContact O-N 3.23Å; L54-P77 HydrophobicContact CB-CB 4.28Å; L54-P77 HydrophobicContact CD1-CG 4.41Å; L54-P77 HydrophobicContact CG-CG 4.34Å; L54-V149 HydrophobicContact CD1-CG2 3.92Å; L54-V149 HydrophobicContact CD2-CB 3.97Å; L54-V149 HydrophobicContact CD2-CG1 3.6Å; L54-V149 HydrophobicContact CD2-CG2 3.31Å; L54-V149 HydrophobicContact CG-CG2 4.1Å
55V94.4Very high95.3Very high74 Ų7471.4 Ų71.445%0.44837%0.366SS..Hα-helixtrans-71.8-43.7175.4176.50000111.1I51 I52 L53 M57 I58I51-V55 WeakPolarHBondContact O-CG2 3.35Å; I51-V55 PolarHBondContact O-N 3.34Å; I52-V55 PolarHBondContact O-N 3.35Å; L53-V55 PolarHBondContact O-N 3.28Å; V55-M57 PolarHBondContact O-N 3.09Å; V55-I58 HydrophobicContact CG1-CD1 4.12Å; V55-I58 WeakPolarHBondContact O-CB 3.25Å; V55-I58 WeakPolarHBondContact O-CD1 3.49Å; V55-I58 WeakPolarHBondContact O-CG1 3.37Å; V55-I58 PolarHBondContact O-N 2.84Å
56W95.9Very high95.1Very high165 Ų16571.4 Ų71.463%0.62538%0.383SS*.Hα-helixtrans-61.7-31179.6178.574.9000112.8F45 I52 L53 I58 P59F45-W56 HydrophobicContact CE1-CZ3 4.5Å; I52-W56 WeakPolarHBondContact O-CB 3.25Å; I52-W56 PolarHBondContact O-N 2.94Å; L53-W56 HydrophobicContact CD1-CE3 4.03Å; L53-W56 HydrophobicContact CD1-CZ3 4.3Å; L53-W56 PolarHBondContact O-N 3.07Å; W56-I58 VanDerWaalsContact C-N 3.35Å; W56-I58 PolarHBondContact O-N 3.06Å; W56-P59 WeakPolarHBondContact O-CD 3.15Å
57M95.7Very high94.8Very high6 Ų669.7 Ų69.73%0.0338%0.383CS..THydrogen-bonded Turntrans-80.5-4.5179.3-76.1-1736900115L53 V55 F60 T61 V76 P77 V80L53-M57 HydrophobicContact CD1-CG 4.03Å; L53-M57 HydrophobicContact CD1-SD 3.78Å; L53-M57 HydrophobicContact CD2-SD 4.37Å; L53-M57 HydrophobicContact CG-CG 4.31Å; L53-M57 HydrophobicContact CG-SD 3.81Å; L53-M57 VanDerWaalsContact O-CB 3.28Å; L53-M57 WeakPolarHBondContact O-CB 3.03Å; L53-M57 VanDerWaalsContact O-CG 3.23Å; L53-M57 WeakPolarHBondContact O-CG 3.31Å; L53-M57 PolarHBondContact O-N 3.35Å; V55-M57 PolarHBondContact O-N 3.09Å; M57-F60 HydrophobicContact CE-CD1 3.54Å; M57-F60 HydrophobicContact CE-CE1 3.8Å; M57-F60 WeakPolarHBondContact O-CB 3.41Å; M57-F60 PolarHBondContact O-N 3.44Å; M57-F60 VanDerWaalsContact O-N 3.1Å; M57-T61 WeakPolarHBondContact O-CB 3.37Å; M57-T61 PolarHBondContact O-N 2.93Å; M57-T61 PolarHBondContact O-OG1 3.26Å; M57-V76 HydrophobicContact CE-CG1 3.97Å; M57-P77 HydrophobicContact CB-CB 4.23Å; M57-P77 HydrophobicContact CE-CB 4.34Å; M57-P77 HydrophobicContact SD-CB 3.8Å; M57-V80 HydrophobicContact CE-CB 3.59Å; M57-V80 HydrophobicContact CE-CG1 3.82Å; M57-V80 HydrophobicContact CE-CG2 3.53Å; M57-V80 HydrophobicContact SD-CB 3.81Å; M57-V80 HydrophobicContact SD-CG1 3.7Å; M57-V80 HydrophobicContact SD-CG2 4.42Å
58I93.8Very high94.2Very high68 Ų6866.9 Ų66.935%0.34936%0.363SS..Hα-helixtrans-46.7-51.9179.6-72.2169.5000114.2V55 W56 F60 T61 R62V55-I58 HydrophobicContact CG1-CD1 4.12Å; V55-I58 WeakPolarHBondContact O-CB 3.25Å; V55-I58 WeakPolarHBondContact O-CD1 3.49Å; V55-I58 WeakPolarHBondContact O-CG1 3.37Å; V55-I58 PolarHBondContact O-N 2.84Å; W56-I58 VanDerWaalsContact C-N 3.35Å; W56-I58 PolarHBondContact O-N 3.06Å; I58-F60 VanDerWaalsContact C-N 3.35Å; I58-F60 PolarHBondContact O-N 2.94Å; I58-T61 PolarHBondContact O-N 3.36Å; I58-R62 WeakPolarHBondContact O-CB 3.41Å; I58-R62 PolarHBondContact O-N 2.85Å
59P95.3Very high93.7Very high87 Ų8770.1 Ų70.157%0.56538%0.38SS*.Hα-helixtrans-62.3-42.3-18022.9-33.7000112.1W56 R62 V63W56-P59 WeakPolarHBondContact O-CD 3.15Å; P59-R62 PolarHBondContact O-N 3.45Å; P59-V63 WeakPolarHBondContact O-CG2 3.13Å; P59-V63 PolarHBondContact O-N 2.9Å; P59-V63 VanDerWaalsContact O-N 3.13Å
60F95.6Very high93.4Very high106 Ų10667.1 Ų67.147%0.46537%0.365SS..Hα-helixtrans-64.4-45.4178177.8-103000111.9M57 I58 R62 V63 I64 V76M57-F60 HydrophobicContact CE-CD1 3.54Å; M57-F60 HydrophobicContact CE-CE1 3.8Å; M57-F60 WeakPolarHBondContact O-CB 3.41Å; M57-F60 PolarHBondContact O-N 3.44Å; M57-F60 VanDerWaalsContact O-N 3.1Å; I58-F60 VanDerWaalsContact C-N 3.35Å; I58-F60 PolarHBondContact O-N 2.94Å; F60-R62 VanDerWaalsContact C-N 3.31Å; F60-R62 PolarHBondContact O-N 2.87Å; F60-V63 PolarHBondContact O-N 3.37Å; F60-V63 VanDerWaalsContact O-N 3.17Å; F60-I64 HydrophobicContact CD1-CD1 3.8Å; F60-I64 HydrophobicContact CD2-CD1 4.36Å; F60-I64 HydrophobicContact CE1-CD1 3.24Å; F60-I64 HydrophobicContact CE1-CG1 4.5Å; F60-I64 HydrophobicContact CE2-CD1 3.85Å; F60-I64 HydrophobicContact CG-CD1 4.35Å; F60-I64 HydrophobicContact CZ-CD1 3.29Å; F60-I64 HydrophobicContact CZ-CG1 4.44Å; F60-I64 PolarHBondContact O-N 2.92Å; F60-I64 VanDerWaalsContact O-N 3.15Å; F60-V76 HydrophobicContact CD1-CG1 4.07Å; F60-V76 HydrophobicContact CE1-CG1 3.93Å
61T94.9Very high93.2Very high5 Ų571.1 Ų71.13%0.03139%0.386CS..Hα-helixtrans-59.2-41.9175.9-61.10000111.6M57 I58 V63 I64 V65 A73 V76M57-T61 WeakPolarHBondContact O-CB 3.37Å; M57-T61 PolarHBondContact O-N 2.93Å; M57-T61 PolarHBondContact O-OG1 3.26Å; I58-T61 PolarHBondContact O-N 3.36Å; T61-V63 VanDerWaalsContact C-N 3.33Å; T61-V63 PolarHBondContact O-N 3.42Å; T61-I64 PolarHBondContact O-N 3.01Å; T61-V65 PolarHBondContact O-N 3.28Å; T61-A73 HydrophobicContact CG2-CB 3.81Å; T61-A73 WeakPolarHBondContact CG2-O 3.35Å; T61-V76 HydrophobicContact CG2-CB 4.22Å; T61-V76 HydrophobicContact CG2-CG2 4.31Å
62R94.2Very high93.1Very high139 Ų13973.5 Ų73.553%0.52540%0.395SS..Hα-helixtrans-63.9-37.1176.9-174179.9-66.3-177-1.1112.2I58 P59 F60 I64 G66 S68I58-R62 WeakPolarHBondContact O-CB 3.41Å; I58-R62 PolarHBondContact O-N 2.85Å; P59-R62 PolarHBondContact O-N 3.45Å; F60-R62 VanDerWaalsContact C-N 3.31Å; F60-R62 PolarHBondContact O-N 2.87Å; R62-I64 VanDerWaalsContact C-N 3.34Å; R62-G66 WeakPolarHBondContact O-CA 3.27Å; R62-G66 PolarHBondContact O-N 3.09Å; R62-S68 PolarHBondContact NH2-OG 3.05Å
63V96.1Very high93Very high128 Ų12869 Ų6978%0.77637%0.372SS*.Hα-helixtrans-65.4-39176171.80000111.4P59 F60 T61P59-V63 WeakPolarHBondContact O-CG2 3.13Å; P59-V63 PolarHBondContact O-N 2.9Å; P59-V63 VanDerWaalsContact O-N 3.13Å; F60-V63 PolarHBondContact O-N 3.37Å; F60-V63 VanDerWaalsContact O-N 3.17Å; T61-V63 VanDerWaalsContact C-N 3.33Å; T61-V63 PolarHBondContact O-N 3.42Å
64I93.9Very high92.9Very high95 Ų9569.2 Ų69.249%0.48738%0.375SS..Hα-helixtrans-78.2-44.1-176.4-66.1175.5000112.5F60 T61 R62 V76F60-I64 HydrophobicContact CD1-CD1 3.8Å; F60-I64 HydrophobicContact CD2-CD1 4.36Å; F60-I64 HydrophobicContact CE1-CD1 3.24Å; F60-I64 HydrophobicContact CE1-CG1 4.5Å; F60-I64 HydrophobicContact CE2-CD1 3.85Å; F60-I64 HydrophobicContact CG-CD1 4.35Å; F60-I64 HydrophobicContact CZ-CD1 3.29Å; F60-I64 HydrophobicContact CZ-CG1 4.44Å; F60-I64 PolarHBondContact O-N 2.92Å; F60-I64 VanDerWaalsContact O-N 3.15Å; T61-I64 PolarHBondContact O-N 3.01Å; R62-I64 VanDerWaalsContact C-N 3.34Å; I64-V76 HydrophobicContact CD1-CG1 4.1Å; I64-V76 HydrophobicContact CG2-CG2 4.42Å
65V93.7Very high92.9Very high42 Ų4270.1 Ų70.126%0.25538%0.38SS..Hα-helixtrans-111.8-9.2-167.6-169.10000112.1T61 T67 Q72 V76T61-V65 PolarHBondContact O-N 3.28Å; V65-T67 HydrophobicContact CG1-CG2 4.15Å; V65-T67 PolarHBondContact O-N 3.02Å; V65-Q72 HydrophobicContact CG1-CB 3.68Å; V65-V76 HydrophobicContact CG2-CG2 3.5Å
66G91.7Very high93Very high63 Ų6367.5 Ų67.565%0.64936%0.363SS*.SBendtrans77.6-7.4-17700000114.6R62R62-G66 WeakPolarHBondContact O-CA 3.27Å; R62-G66 PolarHBondContact O-N 3.09Å
67T89.3Confident93Very high52 Ų5259.8 Ų59.832%0.31934%0.335SS..  trans-138.9154.3179.4-178.20000111.7V65 I69 A73V65-T67 HydrophobicContact CG1-CG2 4.15Å; V65-T67 PolarHBondContact O-N 3.02Å; T67-I69 PolarHBondContact OG1-N 3.09Å; T67-I69 PolarHBondContact OG1-O 2.88Å; T67-A73 HydrophobicContact CG2-CB 4.36Å
68S83.9Confident93.1Very high37 Ų3759.5 Ų59.526%0.25933%0.333SS..SBendtrans-108.63.3174.9540000113.4R62 A73R62-S68 PolarHBondContact NH2-OG 3.05Å; S68-A73 VanDerWaalsContact C-CB 3.46Å
69I86Confident93.2Very high115 Ų11556.9 Ų56.959%0.5932%0.32SS*.SBendtrans-126.4147.9-176-59.8177000109.8T67 G150T67-I69 PolarHBondContact OG1-N 3.09Å; T67-I69 PolarHBondContact OG1-O 2.88Å; I69-G150 WeakPolarHBondContact CG2-O 3.31Å
70G90.1Very high93.3Very high23 Ų2354.4 Ų54.424%0.23730%0.304CS..SBendtrans91.2-176.417400000114.1Q72 A73 A74 G150G70-Q72 VanDerWaalsContact C-N 3.35Å; G70-Q72 PolarHBondContact O-N 3.09Å; G70-A73 PolarHBondContact O-N 3.42Å; G70-A74 PolarHBondContact O-N 2.94Å; G70-A74 VanDerWaalsContact O-N 3.13Å; G70-G150 VanDerWaalsContact CA-O 3.31Å; G70-G150 WeakPolarHBondContact CA-O 3.45Å; G70-G150 PolarHBondContact N-O 3.07Å
71L91.1Very high93.4Very high92 Ų9249.5 Ų49.548%0.48228%0.283SS..Hα-helixtrans-60-42.8-170.7-171.671.3000112.8M1 A74 I75 A151M1-L71 HydrophobicContact CB-CD1 3.5Å; M1-L71 VanDerWaalsContact CB-CD1 3.5Å; M1-L71 HydrophobicContact CB-CG 4.44Å; M1-L71 HydrophobicContact CE-CD1 4.33Å; M1-L71 HydrophobicContact CG-CD1 3.61Å; M1-L71 HydrophobicContact SD-CD1 3.88Å; L71-A74 PolarHBondContact O-N 3.45Å; L71-I75 WeakPolarHBondContact O-CG1 3.38Å; L71-I75 PolarHBondContact O-N 3.03Å; L71-A151 PolarHBondContact N-O 3.39Å
72Q92.1Very high93.5Very high133 Ų13349.4 Ų49.462%0.62128%0.283SS*.Hα-helixtrans-68-41.1-176.9-62.7-177.4-2.600111.6V65 G70 A74 I75V65-Q72 HydrophobicContact CG1-CB 3.68Å; G70-Q72 VanDerWaalsContact C-N 3.35Å; G70-Q72 PolarHBondContact O-N 3.09Å; Q72-A74 VanDerWaalsContact C-N 3.34Å; Q72-A74 PolarHBondContact O-N 3.35Å; Q72-I75 PolarHBondContact O-N 3.49Å
73A93.5Very high93.7Very high5 Ų543.2 Ų43.24%0.04126%0.261CS..Hα-helixtrans-62.3-42.3175.400000111.5T61 T67 S68 G70 I75 V76 P77T61-A73 HydrophobicContact CG2-CB 3.81Å; T61-A73 WeakPolarHBondContact CG2-O 3.35Å; T67-A73 HydrophobicContact CG2-CB 4.36Å; S68-A73 VanDerWaalsContact C-CB 3.46Å; G70-A73 PolarHBondContact O-N 3.42Å; A73-I75 VanDerWaalsContact C-N 3.3Å; A73-I75 PolarHBondContact O-N 2.91Å; A73-V76 PolarHBondContact O-N 3.45Å; A73-P77 WeakPolarHBondContact O-CD 3.41Å
74A94.5Very high93.7Very high7 Ų737.7 Ų37.76%0.05823%0.228CC..Hα-helixtrans-68.2-26.9-177.300000114M1 G70 L71 Q72 V76 P77 L78 A151M1-A74 HydrophobicContact SD-CB 4.18Å; G70-A74 PolarHBondContact O-N 2.94Å; G70-A74 VanDerWaalsContact O-N 3.13Å; L71-A74 PolarHBondContact O-N 3.45Å; Q72-A74 VanDerWaalsContact C-N 3.34Å; Q72-A74 PolarHBondContact O-N 3.35Å; A74-V76 PolarHBondContact O-N 2.9Å; A74-P77 VanDerWaalsContact O-CD 3.3Å; A74-P77 WeakPolarHBondContact O-CD 3.26Å; A74-P77 WeakPolarHBondContact O-CG 3.46Å; A74-L78 HydrophobicContact CB-CD1 4.36Å; A74-L78 VanDerWaalsContact O-CB 3.32Å; A74-L78 WeakPolarHBondContact O-CB 3.4Å; A74-L78 VanDerWaalsContact O-CD1 3.3Å; A74-L78 WeakPolarHBondContact O-CD1 3.49Å; A74-L78 WeakPolarHBondContact O-CG 3.3Å; A74-L78 PolarHBondContact O-N 3.28Å; A74-A151 HydrophobicContact CB-CB 3.36Å
75I95.5Very high93.8Very high31 Ų3135.9 Ų35.916%0.15922%0.217CC..Hα-helixtrans-59.6-37.7-180-73.7164.1000111.2M1 V4 S5 F8 L71 Q72 A73 L78 T79M1-I75 HydrophobicContact CB-CG1 4.14Å; V4-I75 HydrophobicContact CB-CD1 4.35Å; V4-I75 HydrophobicContact CG1-CD1 3.96Å; V4-I75 HydrophobicContact CG1-CG2 4.24Å; S5-I75 WeakPolarHBondContact OG-CA 3.48Å; S5-I75 PolarHBondContact OG-O 3.45Å; F8-I75 HydrophobicContact CD2-CG2 4.49Å; L71-I75 WeakPolarHBondContact O-CG1 3.38Å; L71-I75 PolarHBondContact O-N 3.03Å; Q72-I75 PolarHBondContact O-N 3.49Å; A73-I75 VanDerWaalsContact C-N 3.3Å; A73-I75 PolarHBondContact O-N 2.91Å; I75-L78 PolarHBondContact O-N 2.89Å; I75-T79 WeakPolarHBondContact O-CB 3.4Å; I75-T79 PolarHBondContact O-N 3.2Å; I75-T79 PolarHBondContact O-OG1 2.97Å; I75-T79 VanDerWaalsContact O-OG1 3.1Å
76V96.2Very high94Very high18 Ų1833.9 Ų33.911%0.10921%0.205CC..Hα-helixtrans-62.8-59.5-176.1-176.80000112.5M57 F60 T61 I64 V65 A73 A74 L78 T79 V80M57-V76 HydrophobicContact CE-CG1 3.97Å; F60-V76 HydrophobicContact CD1-CG1 4.07Å; F60-V76 HydrophobicContact CE1-CG1 3.93Å; T61-V76 HydrophobicContact CG2-CB 4.22Å; T61-V76 HydrophobicContact CG2-CG2 4.31Å; I64-V76 HydrophobicContact CD1-CG1 4.1Å; I64-V76 HydrophobicContact CG2-CG2 4.42Å; V65-V76 HydrophobicContact CG2-CG2 3.5Å; A73-V76 PolarHBondContact O-N 3.45Å; A74-V76 PolarHBondContact O-N 2.9Å; V76-L78 VanDerWaalsContact C-N 3.29Å; V76-L78 PolarHBondContact O-N 3.01Å; V76-T79 PolarHBondContact O-N 3.23Å; V76-V80 WeakPolarHBondContact O-CG2 3.42Å; V76-V80 PolarHBondContact O-N 2.6Å
77P96.5Very high94.4Very high4 Ų430.9 Ų30.93%0.02617%0.174CC..Hα-helixtrans-65-32177.326.5-34.2000112.4L54 M57 A73 A74 T79 V80 G81L54-P77 HydrophobicContact CB-CB 4.28Å; L54-P77 HydrophobicContact CD1-CG 4.41Å; L54-P77 HydrophobicContact CG-CG 4.34Å; M57-P77 HydrophobicContact CB-CB 4.23Å; M57-P77 HydrophobicContact CE-CB 4.34Å; M57-P77 HydrophobicContact SD-CB 3.8Å; A73-P77 WeakPolarHBondContact O-CD 3.41Å; A74-P77 VanDerWaalsContact O-CD 3.3Å; A74-P77 WeakPolarHBondContact O-CD 3.26Å; A74-P77 WeakPolarHBondContact O-CG 3.46Å; P77-T79 PolarHBondContact O-N 2.82Å; P77-V80 PolarHBondContact O-N 2.86Å; P77-G81 WeakPolarHBondContact O-CA 3.25Å; P77-G81 PolarHBondContact O-N 3.41Å
78L96.4Very high94.8Very high0 Ų029.7 Ų29.70%016%0.163CC..Hα-helixtrans-61.1-44.4173.9-74.6169.8000111.7M1 S5 F50 A74 I75 V76 A82 L139 Y142M1-L78 HydrophobicContact CB-CD1 3.92Å; M1-L78 HydrophobicContact CG-CD1 4.22Å; M1-L78 HydrophobicContact SD-CD1 4.02Å; S5-L78 VanDerWaalsContact OG-CB 3.25Å; S5-L78 WeakPolarHBondContact OG-CB 3.12Å; F50-L78 HydrophobicContact CE1-CD2 3.98Å; F50-L78 HydrophobicContact CE2-CD2 3.95Å; F50-L78 HydrophobicContact CE2-CG 4.48Å; F50-L78 HydrophobicContact CZ-CD2 3.35Å; F50-L78 HydrophobicContact CZ-CG 3.88Å; A74-L78 HydrophobicContact CB-CD1 4.36Å; A74-L78 VanDerWaalsContact O-CB 3.32Å; A74-L78 WeakPolarHBondContact O-CB 3.4Å; A74-L78 VanDerWaalsContact O-CD1 3.3Å; A74-L78 WeakPolarHBondContact O-CD1 3.49Å; A74-L78 WeakPolarHBondContact O-CG 3.3Å; A74-L78 PolarHBondContact O-N 3.28Å; I75-L78 PolarHBondContact O-N 2.89Å; V76-L78 VanDerWaalsContact C-N 3.29Å; V76-L78 PolarHBondContact O-N 3.01Å; L78-A82 VanDerWaalsContact O-CB 3.25Å; L78-A82 WeakPolarHBondContact O-CB 3.48Å; L78-A82 PolarHBondContact O-N 3.06Å; L78-L139 HydrophobicContact CB-CD2 4.01Å; L78-L139 HydrophobicContact CD2-CD2 3.83Å; L78-Y142 VanDerWaalsContact CD2-CB 3.45Å
79T97.5Very high95.5Very high12 Ų1230.3 Ų30.37%0.07416%0.163CC..Hα-helixtrans-66.7-48177.2-71.20000111.9S5 F8 I12 I75 V76 P77 G81 A82 A83S5-T79 WeakPolarHBondContact CA-OG1 3.33Å; S5-T79 PolarHBondContact O-OG1 3.27Å; F8-T79 HydrophobicContact CB-CG2 3.61Å; I12-T79 HydrophobicContact CD1-CG2 3.94Å; I75-T79 WeakPolarHBondContact O-CB 3.4Å; I75-T79 PolarHBondContact O-N 3.2Å; I75-T79 PolarHBondContact O-OG1 2.97Å; I75-T79 VanDerWaalsContact O-OG1 3.1Å; V76-T79 PolarHBondContact O-N 3.23Å; P77-T79 PolarHBondContact O-N 2.82Å; T79-G81 VanDerWaalsContact C-N 3.3Å; T79-G81 PolarHBondContact O-N 3.28Å; T79-A82 PolarHBondContact O-N 3.1Å; T79-A83 WeakPolarHBondContact O-CB 3.23Å; T79-A83 PolarHBondContact O-N 3.45Å
80V96.9Very high96.1Very high36 Ų3624.8 Ų24.822%0.21813%0.134CC..Hα-helixtrans-65.3-36.3179.3171.10000111.4F45 M57 V76 P77 P84F45-V80 HydrophobicContact CD1-CG1 3.96Å; F45-V80 HydrophobicContact CE1-CG1 3.77Å; M57-V80 HydrophobicContact CE-CB 3.59Å; M57-V80 HydrophobicContact CE-CG1 3.82Å; M57-V80 HydrophobicContact CE-CG2 3.53Å; M57-V80 HydrophobicContact SD-CB 3.81Å; M57-V80 HydrophobicContact SD-CG1 3.7Å; M57-V80 HydrophobicContact SD-CG2 4.42Å; V76-V80 WeakPolarHBondContact O-CG2 3.42Å; V76-V80 PolarHBondContact O-N 2.6Å; P77-V80 PolarHBondContact O-N 2.86Å; V80-P84 WeakPolarHBondContact O-CD 3.45Å
81G96.3Very high96.4Very high2 Ų223.7 Ų23.72%0.02112%0.123CC..Hα-helixtrans-67.4-41.1174.100000112.5L53 P77 T79 F85L53-G81 VanDerWaalsContact CD2-CA 3.44Å; P77-G81 WeakPolarHBondContact O-CA 3.25Å; P77-G81 PolarHBondContact O-N 3.41Å; T79-G81 VanDerWaalsContact C-N 3.3Å; T79-G81 PolarHBondContact O-N 3.28Å; G81-F85 WeakPolarHBondContact O-CD2 3.48Å
82A97.2Very high96.8Very high4 Ų422.8 Ų22.83%0.03312%0.119CC..Hα-helixtrans-77.4-38.3-176.900000114.3L78 T79 F85 I86 T135 L139L78-A82 VanDerWaalsContact O-CB 3.25Å; L78-A82 WeakPolarHBondContact O-CB 3.48Å; L78-A82 PolarHBondContact O-N 3.06Å; T79-A82 PolarHBondContact O-N 3.1Å; A82-F85 PolarHBondContact O-N 3.29Å; A82-I86 HydrophobicContact CB-CD1 4.15Å; A82-I86 WeakPolarHBondContact O-CG1 3.38Å; A82-I86 PolarHBondContact O-N 3.49Å; A82-T135 HydrophobicContact CB-CG2 4.24Å; A82-L139 HydrophobicContact CB-CD1 4.2Å; A82-L139 HydrophobicContact CB-CD2 3.91Å; A82-L139 HydrophobicContact CB-CG 4.18Å
83A98.2Very high97Very high8 Ų816.8 Ų16.87%0.0669%0.092CC..Hα-helixtrans-54.1-42.2-173.600000114.5I12 G13 T79 I86 A87I12-A83 HydrophobicContact CB-CB 3.91Å; I12-A83 HydrophobicContact CG2-CB 3.82Å; G13-A83 WeakPolarHBondContact CA-O 3.46Å; T79-A83 WeakPolarHBondContact O-CB 3.23Å; T79-A83 PolarHBondContact O-N 3.45Å; A83-I86 PolarHBondContact O-N 3.22Å; A83-A87 WeakPolarHBondContact O-CB 3.34Å; A83-A87 PolarHBondContact O-N 3.16Å
84P97.7Very high97.2Very high13 Ų1316.6 Ų16.68%0.0849%0.09CC..Hα-helixtrans-64.5-38175.4-25.636.6000114.2V42 F45 R46 V80 A87 R88V42-P84 HydrophobicContact CG1-CB 4.06Å; V42-P84 WeakPolarHBondContact CG1-O 3.46Å; F45-P84 HydrophobicContact CB-CB 4.17Å; F45-P84 HydrophobicContact CB-CG 3.58Å; F45-P84 HydrophobicContact CG-CG 4.35Å; R46-P84 HydrophobicContact CG-CB 3.61Å; V80-P84 WeakPolarHBondContact O-CD 3.45Å; P84-A87 PolarHBondContact O-N 2.99Å; P84-R88 PolarHBondContact O-N 2.96Å; P84-R88 VanDerWaalsContact O-N 3.16Å
85F96.2Very high97.3Very high57 Ų5719.1 Ų19.125%0.2510%0.102CC..Hα-helixtrans-66.3-46.5175-70.2-81.5000110.4R46 G81 A82 A87 R88 M89 Y142R46-F85 HydrophobicContact CB-CE1 4.21Å; R46-F85 HydrophobicContact CB-CZ 4.11Å; R46-F85 HydrophobicContact CG-CD1 4.15Å; R46-F85 HydrophobicContact CG-CD2 4.38Å; R46-F85 HydrophobicContact CG-CE1 4.1Å; R46-F85 HydrophobicContact CG-CE2 4.33Å; R46-F85 HydrophobicContact CG-CG 4.27Å; R46-F85 HydrophobicContact CG-CZ 4.18Å; G81-F85 WeakPolarHBondContact O-CD2 3.48Å; A82-F85 PolarHBondContact O-N 3.29Å; F85-A87 VanDerWaalsContact C-N 3.32Å; F85-A87 PolarHBondContact O-N 2.96Å; F85-R88 PolarHBondContact O-N 3.38Å; F85-M89 VanDerWaalsContact O-CG 3.3Å; F85-M89 WeakPolarHBondContact O-CG 3.36Å; F85-M89 PolarHBondContact O-N 3.41Å; F85-Y142 WeakPolarHBondContact CE2-OH 3.48Å
86I98.1Very high97.3Very high0 Ų025 Ų250%013%0.129CC..Hα-helixtrans-56.4-48.5175.2-63.4161.9000110.2G9 F10 A82 A83 R88 M89 V90 T135G9-I86 WeakPolarHBondContact O-CD1 3.47Å; F10-I86 HydrophobicContact CD1-CG2 3.82Å; F10-I86 HydrophobicContact CD2-CD1 3.73Å; F10-I86 HydrophobicContact CD2-CG1 4.28Å; F10-I86 HydrophobicContact CD2-CG2 4.38Å; F10-I86 HydrophobicContact CE1-CG2 3.61Å; F10-I86 HydrophobicContact CE2-CD1 3.81Å; F10-I86 HydrophobicContact CE2-CG1 3.88Å; F10-I86 HydrophobicContact CE2-CG2 4.16Å; F10-I86 HydrophobicContact CG-CD1 4.28Å; F10-I86 HydrophobicContact CG-CG2 4.18Å; F10-I86 HydrophobicContact CZ-CD1 4.45Å; F10-I86 HydrophobicContact CZ-CG1 4.12Å; F10-I86 HydrophobicContact CZ-CG2 3.74Å; A82-I86 HydrophobicContact CB-CD1 4.15Å; A82-I86 WeakPolarHBondContact O-CG1 3.38Å; A82-I86 PolarHBondContact O-N 3.49Å; A83-I86 PolarHBondContact O-N 3.22Å; I86-R88 VanDerWaalsContact C-N 3.3Å; I86-R88 PolarHBondContact O-N 3.42Å; I86-M89 PolarHBondContact O-N 2.83Å; I86-M89 VanDerWaalsContact O-N 3.13Å; I86-V90 HydrophobicContact CG2-CG2 4Å; I86-V90 WeakPolarHBondContact O-CB 3.3Å; I86-V90 WeakPolarHBondContact O-CG2 3.46Å; I86-V90 PolarHBondContact O-N 3.13Å; I86-T135 HydrophobicContact CD1-CG2 3.63Å; I86-T135 HydrophobicContact CG1-CG2 3.57Å; I86-T135 WeakPolarHBondContact CG1-OG1 3.37Å
87A98.6Very high97.2Very high0 Ų024.9 Ų24.90%013%0.128CC..Hα-helixtrans-56.2-43.2179.800000112.6G13 V16 G17 L20 V42 A83 P84 F85 E91G13-A87 VanDerWaalsContact O-CA 3.27Å; G13-A87 WeakPolarHBondContact O-CA 3.25Å; G13-A87 WeakPolarHBondContact O-CB 3.42Å; V16-A87 HydrophobicContact CB-CB 3.96Å; V16-A87 HydrophobicContact CG1-CB 3.76Å; G17-A87 WeakPolarHBondContact CA-O 2.96Å; L20-A87 HydrophobicContact CD1-CB 4.39Å; V42-A87 HydrophobicContact CG2-CB 4.44Å; A83-A87 WeakPolarHBondContact O-CB 3.34Å; A83-A87 PolarHBondContact O-N 3.16Å; P84-A87 PolarHBondContact O-N 2.99Å; F85-A87 VanDerWaalsContact C-N 3.32Å; F85-A87 PolarHBondContact O-N 2.96Å; A87-E91 PolarHBondContact O-N 2.79Å
88R98.1Very high97.1Very high27 Ų2728.4 Ų28.410%0.10215%0.151CC..Hα-helixtrans-68.7-41.1177-174.462.661.9-175.6-6.6112.3S39 N43 P84 F85 I86 V90 E91 N92S39-R88 PolarHBondContact OG-NH2 3.04Å; N43-R88 PolarHBondContact OD1-NH2 3.49Å; P84-R88 PolarHBondContact O-N 2.96Å; P84-R88 VanDerWaalsContact O-N 3.16Å; F85-R88 PolarHBondContact O-N 3.38Å; I86-R88 VanDerWaalsContact C-N 3.3Å; I86-R88 PolarHBondContact O-N 3.42Å; R88-V90 VanDerWaalsContact C-N 3.32Å; R88-E91 IonicContact CZ-OE2 2.6Å; R88-E91 VanDerWaalsContact CZ-OE2 3.26Å; R88-E91 IonicContact NE-OE2 3.54Å; R88-E91 IonicContact NH1-OE1 3.26Å; R88-E91 IonicContact NH1-OE2 3.75Å; R88-E91 PolarHBondContact NH1-OE2 2.72Å; R88-E91 PolarHBondContact O-N 2.85Å; R88-N92 WeakPolarHBondContact O-CB 3.19Å; R88-N92 PolarHBondContact O-N 3.12Å; R88-N92 PolarHBondContact O-OD1 2.84Å
89M98.1Very high96.9Very high49 Ų4932.4 Ų32.424%0.24118%0.175CC..Hα-helixtrans-64.8-39.4178-66.8-175.483.100111.6F85 I86 N92 A93 A131 I134F85-M89 VanDerWaalsContact O-CG 3.3Å; F85-M89 WeakPolarHBondContact O-CG 3.36Å; F85-M89 PolarHBondContact O-N 3.41Å; I86-M89 PolarHBondContact O-N 2.83Å; I86-M89 VanDerWaalsContact O-N 3.13Å; M89-N92 PolarHBondContact O-N 3.47Å; M89-A93 WeakPolarHBondContact O-CB 3.48Å; M89-A93 PolarHBondContact O-N 3.18Å; M89-A131 HydrophobicContact CB-CB 3.71Å; M89-A131 HydrophobicContact CE-CB 4Å; M89-A131 HydrophobicContact SD-CB 4.2Å; M89-I134 HydrophobicContact CE-CB 3.8Å; M89-I134 HydrophobicContact CE-CD1 3.51Å; M89-I134 HydrophobicContact CE-CG1 4.24Å; M89-I134 HydrophobicContact CE-CG2 3.78Å; M89-I134 HydrophobicContact SD-CB 4.45Å; M89-I134 HydrophobicContact SD-CG2 4.14Å
90V98.4Very high96.7Very high0 Ų033.7 Ų33.70%019%0.19CC..Hα-helixtrans-62.6-48.6173.1169.60000110.7L14 V18 I86 R88 N92 A93 L94 L128L14-V90 HydrophobicContact CD1-CG1 3.87Å; L14-V90 HydrophobicContact CD1-CG2 3.88Å; V18-V90 HydrophobicContact CG2-CG1 4.24Å; I86-V90 HydrophobicContact CG2-CG2 4Å; I86-V90 WeakPolarHBondContact O-CB 3.3Å; I86-V90 WeakPolarHBondContact O-CG2 3.46Å; I86-V90 PolarHBondContact O-N 3.13Å; R88-V90 VanDerWaalsContact C-N 3.32Å; V90-N92 VanDerWaalsContact C-N 3.28Å; V90-N92 PolarHBondContact O-N 3.3Å; V90-A93 PolarHBondContact O-N 3.45Å; V90-L94 HydrophobicContact CG1-CD1 3.84Å; V90-L94 HydrophobicContact CG1-CG 4.45Å; V90-L94 VanDerWaalsContact O-CG 3.23Å; V90-L94 WeakPolarHBondContact O-CG 3.38Å; V90-L94 PolarHBondContact O-N 3.22Å; V90-L128 HydrophobicContact CB-CD2 4.21Å; V90-L128 HydrophobicContact CG1-CD2 4.06Å; V90-L128 HydrophobicContact CG2-CD2 3.77Å
91E98Very high96.6Very high0 Ų035.1 Ų35.10%020%0.197CC..Hα-helixtrans-55.3-46.1175.8-176.9-171.4172.900111.1L20 R24 Y35 A87 R88 L94 L95L20-E91 HydrophobicContact CB-CB 4.27Å; L20-E91 HydrophobicContact CB-CG 4.11Å; R24-E91 IonicContact CZ-OE1 3.93Å; R24-E91 IonicContact NH1-OE1 2.82Å; R24-E91 PolarHBondContact NH1-OE1 3.37Å; Y35-E91 WeakPolarHBondContact CE2-OE1 3.14Å; Y35-E91 PolarHBondContact OH-OE1 3.31Å; A87-E91 PolarHBondContact O-N 2.79Å; R88-E91 IonicContact CZ-OE2 2.6Å; R88-E91 VanDerWaalsContact CZ-OE2 3.26Å; R88-E91 IonicContact NE-OE2 3.54Å; R88-E91 IonicContact NH1-OE1 3.26Å; R88-E91 IonicContact NH1-OE2 3.75Å; R88-E91 PolarHBondContact NH1-OE2 2.72Å; R88-E91 PolarHBondContact O-N 2.85Å; E91-L94 PolarHBondContact O-N 2.84Å; E91-L95 HydrophobicContact CG-CD1 4.13Å; E91-L95 VanDerWaalsContact O-CG 3.31Å; E91-L95 WeakPolarHBondContact O-CG 3.43Å; E91-L95 PolarHBondContact O-N 3.35Å
92N97.8Very high96.4Very high73 Ų7335.5 Ų35.539%0.3920%0.198SC..Hα-helixtrans-64.1-45179.5-68.1-9.8000112.2R88 M89 V90 L94 L95 E96R88-N92 WeakPolarHBondContact O-CB 3.19Å; R88-N92 PolarHBondContact O-N 3.12Å; R88-N92 PolarHBondContact O-OD1 2.84Å; M89-N92 PolarHBondContact O-N 3.47Å; V90-N92 VanDerWaalsContact C-N 3.28Å; V90-N92 PolarHBondContact O-N 3.3Å; N92-L94 VanDerWaalsContact C-N 3.26Å; N92-L94 PolarHBondContact O-N 2.93Å; N92-L95 WeakPolarHBondContact O-CB 3.5Å; N92-L95 PolarHBondContact O-N 3.18Å; N92-L95 VanDerWaalsContact O-N 3.07Å; N92-E96 PolarHBondContact O-N 3.37Å
93A97.3Very high96.2Very high7 Ų741.2 Ų41.26%0.05822%0.224CC..Hα-helixtrans-61.3-36.4177.900000112.1M89 V90 E96M89-A93 WeakPolarHBondContact O-CB 3.48Å; M89-A93 PolarHBondContact O-N 3.18Å; V90-A93 PolarHBondContact O-N 3.45Å; A93-E96 PolarHBondContact O-N 2.97Å
94L97.3Very high96.1Very high1 Ų143.4 Ų43.41%0.00524%0.242CC..Hα-helixtrans-72.7-28.5176.2-63.2167.8000112.4V18 Y21 V90 E91 N92 E96 I97 L120 L121 A124V18-L94 HydrophobicContact CG2-CD1 4.02Å; Y21-L94 HydrophobicContact CD1-CB 4.26Å; Y21-L94 HydrophobicContact CD1-CD1 4.37Å; Y21-L94 HydrophobicContact CD2-CB 3.38Å; Y21-L94 HydrophobicContact CD2-CD1 4.49Å; Y21-L94 HydrophobicContact CE2-CB 3.7Å; Y21-L94 WeakPolarHBondContact CE2-O 3.26Å; Y21-L94 HydrophobicContact CG-CB 3.66Å; Y21-L94 HydrophobicContact CG-CD1 3.95Å; Y21-L94 HydrophobicContact CG-CG 4.45Å; V90-L94 HydrophobicContact CG1-CD1 3.84Å; V90-L94 HydrophobicContact CG1-CG 4.45Å; V90-L94 VanDerWaalsContact O-CG 3.23Å; V90-L94 WeakPolarHBondContact O-CG 3.38Å; V90-L94 PolarHBondContact O-N 3.22Å; E91-L94 PolarHBondContact O-N 2.84Å; N92-L94 VanDerWaalsContact C-N 3.26Å; N92-L94 PolarHBondContact O-N 2.93Å; L94-E96 VanDerWaalsContact C-N 3.3Å; L94-I97 WeakPolarHBondContact O-CB 3.38Å; L94-I97 PolarHBondContact O-N 2.92Å; L94-L120 HydrophobicContact CD2-CB 3.89Å; L94-L121 HydrophobicContact CD2-CD2 4.46Å; L94-A124 HydrophobicContact CD2-CB 3.77Å
95L96.3Very high96Very high59 Ų5943.2 Ų43.231%0.30924%0.241SC..Hα-helixtrans-72.9-21175.4-73.8167.4000113.5Y21 E91 N92Y21-L95 HydrophobicContact CD2-CD2 4.01Å; Y21-L95 HydrophobicContact CD2-CG 4Å; Y21-L95 HydrophobicContact CE2-CD2 3.88Å; Y21-L95 HydrophobicContact CE2-CG 4.14Å; E91-L95 HydrophobicContact CG-CD1 4.13Å; E91-L95 VanDerWaalsContact O-CG 3.31Å; E91-L95 WeakPolarHBondContact O-CG 3.43Å; E91-L95 PolarHBondContact O-N 3.35Å; N92-L95 WeakPolarHBondContact O-CB 3.5Å; N92-L95 PolarHBondContact O-N 3.18Å; N92-L95 VanDerWaalsContact O-N 3.07Å
96E95.4Very high95.8Very high154 Ų15446 Ų4672%0.7225%0.25SC*.THydrogen-bonded Turntrans-75.7-14174.2-69.3174.3-175.500112.5N92 A93 L94N92-E96 PolarHBondContact O-N 3.37Å; A93-E96 PolarHBondContact O-N 2.97Å; L94-E96 VanDerWaalsContact C-N 3.3Å
97I94.8Very high95.7Very high17 Ų1750.2 Ų50.29%0.08729%0.285CS..SBendtrans-72.3129179.1-55-49.8000110.3L94 T99 L101 L120 E123 A124L94-I97 WeakPolarHBondContact O-CB 3.38Å; L94-I97 PolarHBondContact O-N 2.92Å; I97-T99 PolarHBondContact O-N 2.97Å; I97-L101 HydrophobicContact CG2-CD1 4.01Å; I97-L120 HydrophobicContact CB-CD2 4.31Å; I97-L120 HydrophobicContact CG2-CD2 4.09Å; I97-E123 HydrophobicContact CD1-CB 4.01Å; I97-E123 HydrophobicContact CD1-CG 3.77Å; I97-E123 HydrophobicContact CG2-CB 4.43Å; I97-E123 HydrophobicContact CG2-CG 4.15Å; I97-A124 HydrophobicContact CD1-CB 4.09Å; I97-A124 HydrophobicContact CG1-CB 4.25Å
98P94.1Very high95.6Very high78 Ų7857.6 Ų57.651%0.50632%0.322SS..  trans-55129.4179.2-26.634000112.6G100 L101P98-G100 PolarHBondContact O-N 3.49Å; P98-G100 VanDerWaalsContact O-N 3.16Å; P98-L101 PolarHBondContact O-N 3.3Å; P98-L101 VanDerWaalsContact O-N 3.13Å
99T91.9Very high95.4Very high84 Ų8459.2 Ų59.252%0.51535%0.347SS..Hα-helixtrans-59.6-29.7179.155.40000112.4I97 L101 I102 E103I97-T99 PolarHBondContact O-N 2.97Å; T99-L101 VanDerWaalsContact C-N 3.26Å; T99-L101 PolarHBondContact O-N 2.86Å; T99-I102 WeakPolarHBondContact O-CA 3.46Å; T99-I102 WeakPolarHBondContact O-CB 3.45Å; T99-I102 PolarHBondContact O-N 3.04Å; T99-E103 WeakPolarHBondContact O-CG 3.32Å; T99-E103 PolarHBondContact O-N 3.39Å
100G94.2Very high95.3Very high38 Ų3858.3 Ų58.339%0.39235%0.347SS..Hα-helixtrans-57.3-33.5176.600000114.1P98 I102 E103 A104P98-G100 PolarHBondContact O-N 3.49Å; P98-G100 VanDerWaalsContact O-N 3.16Å; G100-I102 VanDerWaalsContact C-N 3.3Å; G100-I102 PolarHBondContact O-N 2.85Å; G100-E103 PolarHBondContact O-N 3.09Å; G100-A104 VanDerWaalsContact O-CB 3.25Å; G100-A104 WeakPolarHBondContact O-CB 3.48Å; G100-A104 PolarHBondContact O-N 2.85Å
101L93.6Very high95.1Very high67 Ų6761.6 Ų61.635%0.35137%0.367SS..Hα-helixtrans-66-36.2175.1-71.2174.1000111.6I97 P98 T99 S105 V119 E123I97-L101 HydrophobicContact CG2-CD1 4.01Å; P98-L101 PolarHBondContact O-N 3.3Å; P98-L101 VanDerWaalsContact O-N 3.13Å; T99-L101 VanDerWaalsContact C-N 3.26Å; T99-L101 PolarHBondContact O-N 2.86Å; L101-S105 VanDerWaalsContact O-CB 3.3Å; L101-S105 WeakPolarHBondContact O-CB 3.21Å; L101-S105 PolarHBondContact O-N 3.43Å; L101-S105 PolarHBondContact O-OG 3.36Å; L101-V119 HydrophobicContact CB-CG1 4.18Å; L101-E123 HydrophobicContact CD1-CG 4.02Å
102I93.3Very high94.9Very high9 Ų964.1 Ų64.15%0.04638%0.383CS..Hα-helixtrans-73.3-44.8179.8-54.8170.3000109.8Y21 I28 T99 G100 S105 R106 I115 L120Y21-I102 WeakPolarHBondContact OH-CD1 3.41Å; I28-I102 HydrophobicContact CD1-CG2 4.3Å; I28-I102 HydrophobicContact CG1-CG2 4.12Å; T99-I102 WeakPolarHBondContact O-CA 3.46Å; T99-I102 WeakPolarHBondContact O-CB 3.45Å; T99-I102 PolarHBondContact O-N 3.04Å; G100-I102 VanDerWaalsContact C-N 3.3Å; G100-I102 PolarHBondContact O-N 2.85Å; I102-S105 PolarHBondContact O-N 3.02Å; I102-R106 WeakPolarHBondContact O-CB 3.33Å; I102-R106 WeakPolarHBondContact O-CG 3.19Å; I102-R106 PolarHBondContact O-N 3.13Å; I102-I115 HydrophobicContact CG2-CG2 4.25Å; I102-L120 HydrophobicContact CD1-CD2 3.9Å; I102-L120 HydrophobicContact CG1-CD2 3.93Å
103E92.8Very high94.8Very high125 Ų12565.9 Ų65.958%0.58439%0.391SS*.Hα-helixtrans-61.6-46.9176.7-70.5169-168.900111.4T99 G100 S105 R106 A107T99-E103 WeakPolarHBondContact O-CG 3.32Å; T99-E103 PolarHBondContact O-N 3.39Å; G100-E103 PolarHBondContact O-N 3.09Å; E103-S105 PolarHBondContact O-N 3.45Å; E103-R106 WeakPolarHBondContact O-CB 3.39Å; E103-R106 PolarHBondContact O-N 3.49Å; E103-A107 PolarHBondContact O-N 2.91Å
104A95.9Very high94.7Very high53 Ų5369.5 Ų69.544%0.43841%0.406SS..Hα-helixtrans-60.9-44175.400000111.7G100 R106 A107 M108G100-A104 VanDerWaalsContact O-CB 3.25Å; G100-A104 WeakPolarHBondContact O-CB 3.48Å; G100-A104 PolarHBondContact O-N 2.85Å; A104-R106 VanDerWaalsContact C-N 3.31Å; A104-R106 PolarHBondContact O-N 3.15Å; A104-A107 PolarHBondContact O-N 3.37Å; A104-M108 WeakPolarHBondContact O-CG 3.41Å; A104-M108 PolarHBondContact O-N 3.21Å; A104-M108 VanDerWaalsContact O-N 3.09Å
105S95.4Very high94.7Very high10 Ų1069.5 Ų69.57%0.0741%0.406CS..Hα-helixtrans-62.5-39.1177.1-60.60000112.3L101 I102 E103 M108 A110 V119L101-S105 VanDerWaalsContact O-CB 3.3Å; L101-S105 WeakPolarHBondContact O-CB 3.21Å; L101-S105 PolarHBondContact O-N 3.43Å; L101-S105 PolarHBondContact O-OG 3.36Å; I102-S105 PolarHBondContact O-N 3.02Å; E103-S105 PolarHBondContact O-N 3.45Å; S105-M108 PolarHBondContact O-N 3.1Å; S105-A110 WeakPolarHBondContact O-CB 3.42Å; S105-A110 PolarHBondContact O-N 2.93Å; S105-V119 WeakPolarHBondContact OG-CG2 3.32Å
106R92.9Very high94.7Very high114 Ų11467.3 Ų67.343%0.4340%0.395SS..Hα-helixtrans-66.5-41174.4-78.2178.7157.5-160.5-17.9112.5I28 I102 E103 A104 M108 G109 I115I28-R106 VanDerWaalsContact C-NH2 3.34Å; I28-R106 PolarHBondContact O-NH2 3.08Å; I102-R106 WeakPolarHBondContact O-CB 3.33Å; I102-R106 WeakPolarHBondContact O-CG 3.19Å; I102-R106 PolarHBondContact O-N 3.13Å; E103-R106 WeakPolarHBondContact O-CB 3.39Å; E103-R106 PolarHBondContact O-N 3.49Å; A104-R106 VanDerWaalsContact C-N 3.31Å; A104-R106 PolarHBondContact O-N 3.15Å; R106-M108 PolarHBondContact O-N 3.21Å; R106-G109 WeakPolarHBondContact O-CA 3.5Å; R106-G109 PolarHBondContact O-N 3.26Å; R106-I115 HydrophobicContact CG-CD1 3.55Å
107A95.2Very high94.8Very high90 Ų9068.1 Ų68.174%0.74439%0.392SS*.Hα-helixtrans-62.3-30.9176.600000112.2E103 A104 G109E103-A107 PolarHBondContact O-N 2.91Å; A104-A107 PolarHBondContact O-N 3.37Å; A107-G109 PolarHBondContact O-N 2.86Å
108M95.8Very high94.8Very high155 Ų15574.7 Ų74.776%0.76442%0.419SS*.THydrogen-bonded Turntrans-77.93.4171.5-65.2-173.7-68.200114A104 S105 R106A104-M108 WeakPolarHBondContact O-CG 3.41Å; A104-M108 PolarHBondContact O-N 3.21Å; A104-M108 VanDerWaalsContact O-N 3.09Å; S105-M108 PolarHBondContact O-N 3.1Å; R106-M108 PolarHBondContact O-N 3.21Å
109G94.8Very high94.9Very high61 Ų6172.4 Ų72.463%0.62940%0.404SS*.THydrogen-bonded Turntrans79.216.6179.300000114.8R106 A107 T111R106-G109 WeakPolarHBondContact O-CA 3.5Å; R106-G109 PolarHBondContact O-N 3.26Å; A107-G109 PolarHBondContact O-N 2.86Å; G109-T111 PolarHBondContact O-N 3.45Å
110A95.9Very high95.1Very high29 Ų2968.4 Ų68.424%0.2438%0.38CS..  trans-65.8130177.600000111.5S105 Q114 I115S105-A110 WeakPolarHBondContact O-CB 3.42Å; S105-A110 PolarHBondContact O-N 2.93Å; A110-Q114 HydrophobicContact CB-CB 4.34Å; A110-I115 HydrophobicContact CB-CD1 4.5Å; A110-I115 HydrophobicContact CB-CG1 3.83Å
111T95.2Very high95.2Very high69 Ų6968.7 Ų68.742%0.42337%0.372SS..  trans-66.9156.3174.261.70000111.1G109 M113 Q114 I115G109-T111 PolarHBondContact O-N 3.45Å; T111-M113 VanDerWaalsContact C-N 3.26Å; T111-M113 PolarHBondContact O-N 3.4Å; T111-M113 VanDerWaalsContact O-N 3.16Å; T111-Q114 WeakPolarHBondContact O-CA 3.27Å; T111-Q114 WeakPolarHBondContact O-CB 3.1Å; T111-Q114 PolarHBondContact O-N 3.17Å; T111-Q114 WeakPolarHBondContact OG1-CB 3.5Å; T111-Q114 WeakPolarHBondContact OG1-CG 2.99Å; T111-Q114 PolarHBondContact OG1-N 3.15Å; T111-Q114 PolarHBondContact OG1-OE1 3.4Å; T111-I115 WeakPolarHBondContact O-CG1 3.43Å; T111-I115 PolarHBondContact O-N 3.25Å
112P93.3Very high95.3Very high53 Ų5368.7 Ų68.734%0.34438%0.376SS..Hα-helixtrans-49.8-43177.2-32.538000114.7I28 I29 I115 V116I28-P112 HydrophobicContact CG2-CB 3.51Å; I28-P112 HydrophobicContact CG2-CG 3.81Å; I29-P112 HydrophobicContact CD1-CB 3.71Å; I29-P112 HydrophobicContact CD1-CG 4.34Å; I29-P112 HydrophobicContact CG1-CB 3.85Å; I29-P112 HydrophobicContact CG1-CG 4.17Å; P112-I115 PolarHBondContact O-N 2.96Å; P112-V116 WeakPolarHBondContact O-CG2 3.24Å; P112-V116 PolarHBondContact O-N 3.01Å; P112-V116 VanDerWaalsContact O-N 3.08Å
113M94.6Very high95.4Very high111 Ų11173.5 Ų73.555%0.54740%0.398SS..Hα-helixtrans-68.7-34.3179-173.461.772.800112.3T111 R117T111-M113 VanDerWaalsContact C-N 3.26Å; T111-M113 PolarHBondContact O-N 3.4Å; T111-M113 VanDerWaalsContact O-N 3.16Å; M113-R117 WeakPolarHBondContact O-CB 3.49Å; M113-R117 WeakPolarHBondContact O-CG 3.3Å; M113-R117 PolarHBondContact O-N 2.82Å; M113-R117 HydrophobicContact SD-CG 4.23Å; M113-R117 PolarHBondContact SD-NE 3.34Å
114Q96.7Very high95.6Very high82 Ų8267.7 Ų67.738%0.38337%0.372SS..Hα-helixtrans-67.5-42.7174.3-74.3165.8-30.900111.3A110 T111 V116 R117 K118A110-Q114 HydrophobicContact CB-CB 4.34Å; T111-Q114 WeakPolarHBondContact O-CA 3.27Å; T111-Q114 WeakPolarHBondContact O-CB 3.1Å; T111-Q114 PolarHBondContact O-N 3.17Å; T111-Q114 WeakPolarHBondContact OG1-CB 3.5Å; T111-Q114 WeakPolarHBondContact OG1-CG 2.99Å; T111-Q114 PolarHBondContact OG1-N 3.15Å; T111-Q114 PolarHBondContact OG1-OE1 3.4Å; Q114-V116 VanDerWaalsContact C-N 3.34Å; Q114-V116 PolarHBondContact O-N 3.06Å; Q114-R117 PolarHBondContact O-N 3.36Å; Q114-K118 VanDerWaalsContact O-CB 3.25Å; Q114-K118 WeakPolarHBondContact O-CB 3.17Å; Q114-K118 PolarHBondContact O-N 3.24Å
115I96.3Very high95.6Very high1 Ų168.6 Ų68.61%0.00537%0.369CS..Hα-helixtrans-59-47.5176.6-62.6167.7000110.1I28 I102 R106 A110 T111 P112 V119 L120I28-I115 HydrophobicContact CD1-CB 4.1Å; I28-I115 HydrophobicContact CD1-CG2 3.57Å; I28-I115 HydrophobicContact CG2-CD1 4.44Å; I102-I115 HydrophobicContact CG2-CG2 4.25Å; R106-I115 HydrophobicContact CG-CD1 3.55Å; A110-I115 HydrophobicContact CB-CD1 4.5Å; A110-I115 HydrophobicContact CB-CG1 3.83Å; T111-I115 WeakPolarHBondContact O-CG1 3.43Å; T111-I115 PolarHBondContact O-N 3.25Å; P112-I115 PolarHBondContact O-N 2.96Å; I115-V119 WeakPolarHBondContact O-CA 3.08Å; I115-V119 VanDerWaalsContact O-CB 3.28Å; I115-V119 WeakPolarHBondContact O-CB 3.3Å; I115-V119 PolarHBondContact O-N 3.36Å; I115-L120 HydrophobicContact CG2-CD1 4.16Å; I115-L120 HydrophobicContact CG2-CG 4.09Å; I115-L120 PolarHBondContact O-N 3.44Å
116V96.5Very high95.6Very high13 Ų1369.7 Ų69.78%0.07938%0.376CS..Iπ-helixtrans-58.9-53.7177.9171.90000111.6V18 V22 P112 Q114 L120 L121V18-V116 HydrophobicContact CG1-CG1 3.62Å; V18-V116 HydrophobicContact CG1-CG2 4.31Å; V22-V116 HydrophobicContact CG1-CG2 3.67Å; P112-V116 WeakPolarHBondContact O-CG2 3.24Å; P112-V116 PolarHBondContact O-N 3.01Å; P112-V116 VanDerWaalsContact O-N 3.08Å; Q114-V116 VanDerWaalsContact C-N 3.34Å; Q114-V116 PolarHBondContact O-N 3.06Å; V116-L120 HydrophobicContact CG2-CD1 4.15Å; V116-L121 HydrophobicContact CG1-CD1 4.11Å; V116-L121 HydrophobicContact CG1-CG 4.2Å; V116-L121 WeakPolarHBondContact O-CB 3.25Å; V116-L121 WeakPolarHBondContact O-CG 3.45Å; V116-L121 PolarHBondContact O-N 3.23Å
117R96.8Very high95.8Very high172 Ų17265.3 Ų65.365%0.64937%0.366SS*.Iπ-helixtrans-75.8-33.5-171.3-70.2-177.1178.1-170.5-1.4114.2M113 Q114 P122M113-R117 WeakPolarHBondContact O-CB 3.49Å; M113-R117 WeakPolarHBondContact O-CG 3.3Å; M113-R117 PolarHBondContact O-N 2.82Å; M113-R117 HydrophobicContact SD-CG 4.23Å; M113-R117 PolarHBondContact SD-NE 3.34Å; Q114-R117 PolarHBondContact O-N 3.36Å; R117-P122 WeakPolarHBondContact O-CD 3.46Å
118K95.7Very high95.9Very high154 Ų15461.9 Ų61.967%0.6734%0.335SS*.Iπ-helixtrans-104.6-16-170.9-60.3-172174.6-172.70114Q114Q114-K118 VanDerWaalsContact O-CB 3.25Å; Q114-K118 WeakPolarHBondContact O-CB 3.17Å; Q114-K118 PolarHBondContact O-N 3.24Å
119V95.3Very high96Very high30 Ų3055.6 Ų55.618%0.18231%0.305CS..Iπ-helixtrans-122.4-63.3-176.4-173.40000109.6L101 S105 I115 P122 E123L101-V119 HydrophobicContact CB-CG1 4.18Å; S105-V119 WeakPolarHBondContact OG-CG2 3.32Å; I115-V119 WeakPolarHBondContact O-CA 3.08Å; I115-V119 VanDerWaalsContact O-CB 3.28Å; I115-V119 WeakPolarHBondContact O-CB 3.3Å; I115-V119 PolarHBondContact O-N 3.36Å; V119-P122 WeakPolarHBondContact O-CD 3.36Å; V119-E123 WeakPolarHBondContact O-CB 3.14Å; V119-E123 PolarHBondContact O-N 3.48Å
120L96.1Very high96.1Very high1 Ų155.9 Ų55.91%0.00529%0.292CS..Iπ-helixtrans-66.3-50.6-171.8-65.6175.1000113.6Y21 I28 L94 I97 I102 I115 V116 E123 A124Y21-L120 HydrophobicContact CD1-CD1 4Å; Y21-L120 HydrophobicContact CE1-CD1 3.41Å; Y21-L120 VanDerWaalsContact CE1-CD1 3.41Å; Y21-L120 HydrophobicContact CE1-CD2 4.25Å; Y21-L120 HydrophobicContact CE1-CG 4.49Å; I28-L120 HydrophobicContact CD1-CD1 3.75Å; L94-L120 HydrophobicContact CD2-CB 3.89Å; I97-L120 HydrophobicContact CB-CD2 4.31Å; I97-L120 HydrophobicContact CG2-CD2 4.09Å; I102-L120 HydrophobicContact CD1-CD2 3.9Å; I102-L120 HydrophobicContact CG1-CD2 3.93Å; I115-L120 HydrophobicContact CG2-CD1 4.16Å; I115-L120 HydrophobicContact CG2-CG 4.09Å; I115-L120 PolarHBondContact O-N 3.44Å; V116-L120 HydrophobicContact CG2-CD1 4.15Å; L120-E123 PolarHBondContact O-N 3.43Å; L120-A124 WeakPolarHBondContact O-CB 3.15Å; L120-A124 PolarHBondContact O-N 2.98Å
121L96.6Very high96.2Very high43 Ų4354.6 Ų54.623%0.22528%0.282CS..Hα-helixtrans-66.8-42.5-178-68.4177000113.1L14 V18 L94 V116 L125 L128L14-L121 HydrophobicContact CD1-CD2 4.25Å; V18-L121 HydrophobicContact CG2-CD2 3.91Å; L94-L121 HydrophobicContact CD2-CD2 4.46Å; V116-L121 HydrophobicContact CG1-CD1 4.11Å; V116-L121 HydrophobicContact CG1-CG 4.2Å; V116-L121 WeakPolarHBondContact O-CB 3.25Å; V116-L121 WeakPolarHBondContact O-CG 3.45Å; V116-L121 PolarHBondContact O-N 3.23Å; L121-L125 PolarHBondContact O-N 3.38Å; L121-L128 HydrophobicContact CD2-CD1 3.99Å
122P95.6Very high96.3Very high68 Ų6852.5 Ų52.544%0.44227%0.272SS..Hα-helixtrans-61.7-45.1172.8-26.937.6000113.1R117 V119 L125R117-P122 WeakPolarHBondContact O-CD 3.46Å; V119-P122 WeakPolarHBondContact O-CD 3.36Å; P122-L125 WeakPolarHBondContact O-CB 3.36Å; P122-L125 PolarHBondContact O-N 3.29Å
123E95.4Very high96.5Very high109 Ų10950.3 Ų50.351%0.50926%0.258SS..Hα-helixtrans-70.1-35.7-177.7-162.466.6-165.300112I97 L101 V119 L120 L125I97-E123 HydrophobicContact CD1-CB 4.01Å; I97-E123 HydrophobicContact CD1-CG 3.77Å; I97-E123 HydrophobicContact CG2-CB 4.43Å; I97-E123 HydrophobicContact CG2-CG 4.15Å; L101-E123 HydrophobicContact CD1-CG 4.02Å; V119-E123 WeakPolarHBondContact O-CB 3.14Å; V119-E123 PolarHBondContact O-N 3.48Å; L120-E123 PolarHBondContact O-N 3.43Å; E123-L125 PolarHBondContact O-N 3.32Å
124A96.5Very high96.7Very high4 Ų448 Ų483%0.03325%0.247CC..THydrogen-bonded Turntrans-79.3-2.3176.800000113.3L94 I97 L120 P126 G127 L128L94-A124 HydrophobicContact CD2-CB 3.77Å; I97-A124 HydrophobicContact CD1-CB 4.09Å; I97-A124 HydrophobicContact CG1-CB 4.25Å; L120-A124 WeakPolarHBondContact O-CB 3.15Å; L120-A124 PolarHBondContact O-N 2.98Å; A124-P126 VanDerWaalsContact C-CD 3.5Å; A124-G127 CarbonylContact O-C 3.58Å; A124-G127 WeakPolarHBondContact O-CA 3.37Å; A124-G127 PolarHBondContact O-N 3.45Å; A124-L128 HydrophobicContact CB-CD1 4.38Å; A124-L128 HydrophobicContact CB-CG 4.22Å; A124-L128 WeakPolarHBondContact O-CG 3.47Å; A124-L128 PolarHBondContact O-N 3.5Å
125L96.5Very high96.7Very high72 Ų7244.3 Ų44.338%0.37723%0.23SC..Hα-helixtrans-55.3-41.8-171-168.762.5000113.7L121 P122 E123 G127 L128 V129 V196L121-L125 PolarHBondContact O-N 3.38Å; P122-L125 WeakPolarHBondContact O-CB 3.36Å; P122-L125 PolarHBondContact O-N 3.29Å; E123-L125 PolarHBondContact O-N 3.32Å; L125-G127 VanDerWaalsContact C-N 3.34Å; L125-G127 PolarHBondContact O-N 3.19Å; L125-L128 PolarHBondContact O-N 2.96Å; L125-V129 VanDerWaalsContact O-CG2 3.3Å; L125-V129 WeakPolarHBondContact O-CG2 3.38Å; L125-V129 PolarHBondContact O-N 3.28Å; L125-V196 HydrophobicContact CB-CG1 3.75Å; L125-V196 HydrophobicContact CD2-CG1 3.47Å; L125-V196 VanDerWaalsContact CD2-CG1 3.47Å; L125-V196 HydrophobicContact CD2-CG2 4.23Å; L125-V196 HydrophobicContact CG-CG1 3.56Å; L125-V196 HydrophobicContact CG-CG2 4.44Å
126P96.6Very high96.8Very high33 Ų3345.9 Ų45.921%0.21424%0.238CC..Hα-helixtrans-57.1-44.7172.1-25.235.7000113.1A124 V129 N130 V193 V196 T197A124-P126 VanDerWaalsContact C-CD 3.5Å; P126-V129 PolarHBondContact O-N 3.27Å; P126-N130 PolarHBondContact O-N 2.89Å; P126-V193 HydrophobicContact CB-CG1 4.26Å; P126-V196 HydrophobicContact CG-CG1 4.01Å; P126-T197 WeakPolarHBondContact CB-OG1 3.25Å; P126-T197 WeakPolarHBondContact CG-OG1 3.35Å
127G96.8Very high96.9Very high22 Ų2247.1 Ų47.123%0.22724%0.244CC..Hα-helixtrans-66.3-37.417700000112.9A124 L125 N130 A131A124-G127 CarbonylContact O-C 3.58Å; A124-G127 WeakPolarHBondContact O-CA 3.37Å; A124-G127 PolarHBondContact O-N 3.45Å; L125-G127 VanDerWaalsContact C-N 3.34Å; L125-G127 PolarHBondContact O-N 3.19Å; G127-N130 PolarHBondContact O-N 2.78Å; G127-A131 WeakPolarHBondContact O-CB 3.47Å; G127-A131 PolarHBondContact O-N 3.5Å
128L97.6Very high96.9Very high17 Ų1741.5 Ų41.59%0.08923%0.228CC..Hα-helixtrans-67.3-40176.4-63.9177.5000112.1L14 V90 L121 A124 L125 A131 A132L14-L128 HydrophobicContact CD1-CD1 4.31Å; L14-L128 HydrophobicContact CD1-CD2 4.01Å; V90-L128 HydrophobicContact CB-CD2 4.21Å; V90-L128 HydrophobicContact CG1-CD2 4.06Å; V90-L128 HydrophobicContact CG2-CD2 3.77Å; L121-L128 HydrophobicContact CD2-CD1 3.99Å; A124-L128 HydrophobicContact CB-CD1 4.38Å; A124-L128 HydrophobicContact CB-CG 4.22Å; A124-L128 WeakPolarHBondContact O-CG 3.47Å; A124-L128 PolarHBondContact O-N 3.5Å; L125-L128 PolarHBondContact O-N 2.96Å; L128-A131 WeakPolarHBondContact O-CB 3.37Å; L128-A131 PolarHBondContact O-N 3.06Å; L128-A132 PolarHBondContact O-N 3.35Å
129V97.3Very high96.9Very high23 Ų2334.2 Ų34.214%0.13920%0.197CC..Hα-helixtrans-65.6-41.8174.2173.60000110.6L125 P126 A131 A132 T133 I192 V193L125-V129 VanDerWaalsContact O-CG2 3.3Å; L125-V129 WeakPolarHBondContact O-CG2 3.38Å; L125-V129 PolarHBondContact O-N 3.28Å; P126-V129 PolarHBondContact O-N 3.27Å; V129-A131 VanDerWaalsContact C-N 3.34Å; V129-A131 PolarHBondContact O-N 3.3Å; V129-A132 WeakPolarHBondContact O-CB 3.33Å; V129-A132 PolarHBondContact O-N 3Å; V129-T133 PolarHBondContact O-N 2.83Å; V129-T133 PolarHBondContact O-OG1 3.45Å; V129-I192 HydrophobicContact CB-CG2 4.41Å; V129-I192 HydrophobicContact CG1-CB 3.81Å; V129-I192 HydrophobicContact CG1-CG2 3.56Å; V129-I192 HydrophobicContact CG2-CG2 3.94Å; V129-V193 HydrophobicContact CB-CG2 3.96Å; V129-V193 HydrophobicContact CG1-CG2 3.59Å
130N97.4Very high97Very high67 Ų6733 Ų3336%0.35819%0.189SC..Hα-helixtrans-60.9-44.4174.3-176.348.7000111.3P126 G127 A132 T133 I134 V193P126-N130 PolarHBondContact O-N 2.89Å; G127-N130 PolarHBondContact O-N 2.78Å; N130-A132 VanDerWaalsContact C-N 3.28Å; N130-A132 PolarHBondContact O-N 3.29Å; N130-T133 WeakPolarHBondContact O-CB 3.26Å; N130-T133 PolarHBondContact O-N 3.29Å; N130-I134 WeakPolarHBondContact O-CG1 3.37Å; N130-I134 PolarHBondContact O-N 3.23Å; N130-V193 HydrophobicContact CB-CG2 4.39Å
131A97.6Very high96.9Very high2 Ų234.6 Ų34.62%0.01721%0.207CC..Hα-helixtrans-58.9-39.517400000112.3M89 G127 L128 V129 T135M89-A131 HydrophobicContact CB-CB 3.71Å; M89-A131 HydrophobicContact CE-CB 4Å; M89-A131 HydrophobicContact SD-CB 4.2Å; G127-A131 WeakPolarHBondContact O-CB 3.47Å; G127-A131 PolarHBondContact O-N 3.5Å; L128-A131 WeakPolarHBondContact O-CB 3.37Å; L128-A131 PolarHBondContact O-N 3.06Å; V129-A131 VanDerWaalsContact C-N 3.34Å; V129-A131 PolarHBondContact O-N 3.3Å; A131-T135 VanDerWaalsContact O-CB 3.26Å; A131-T135 WeakPolarHBondContact O-CB 3.19Å; A131-T135 PolarHBondContact O-N 3.05Å; A131-T135 PolarHBondContact O-OG1 3.47Å
132A97.4Very high96.9Very high26 Ų2634.3 Ų34.322%0.21520%0.203CC..Hα-helixtrans-65.1-42.1175.700000112.8F10 L128 V129 N130 T135 L136F10-A132 HydrophobicContact CD2-CB 4.47Å; F10-A132 HydrophobicContact CE1-CB 4.07Å; F10-A132 VanDerWaalsContact CE2-CA 3.41Å; F10-A132 HydrophobicContact CE2-CB 3.62Å; F10-A132 HydrophobicContact CZ-CB 3.41Å; F10-A132 VanDerWaalsContact CZ-CB 3.41Å; L128-A132 PolarHBondContact O-N 3.35Å; V129-A132 WeakPolarHBondContact O-CB 3.33Å; V129-A132 PolarHBondContact O-N 3Å; N130-A132 VanDerWaalsContact C-N 3.28Å; N130-A132 PolarHBondContact O-N 3.29Å; A132-T135 PolarHBondContact O-N 3.45Å; A132-L136 VanDerWaalsContact O-CG 3.32Å; A132-L136 WeakPolarHBondContact O-CG 3.48Å; A132-L136 PolarHBondContact O-N 3.21Å
133T97.8Very high96.8Very high7 Ų731.8 Ų31.84%0.04319%0.187CC..Hα-helixtrans-61.1-52.7177.6-54.50000110.9V129 N130 T135 L136 I137 I185 G189V129-T133 PolarHBondContact O-N 2.83Å; V129-T133 PolarHBondContact O-OG1 3.45Å; N130-T133 WeakPolarHBondContact O-CB 3.26Å; N130-T133 PolarHBondContact O-N 3.29Å; T133-T135 VanDerWaalsContact C-N 3.3Å; T133-T135 PolarHBondContact O-N 2.87Å; T133-L136 PolarHBondContact O-N 2.89Å; T133-I137 HydrophobicContact CG2-CD1 4.16Å; T133-I137 WeakPolarHBondContact O-CG1 3.28Å; T133-I137 PolarHBondContact O-N 2.89Å; T133-I185 HydrophobicContact CG2-CG2 4.3Å; T133-G189 WeakPolarHBondContact OG1-CA 3.41Å
134I97.9Very high96.7Very high62 Ų6228 Ų2832%0.31817%0.174SC..Hα-helixtrans-59-44.1178.1-68.8166.1000110.6M89 N130 L136 I137 T138M89-I134 HydrophobicContact CE-CB 3.8Å; M89-I134 HydrophobicContact CE-CD1 3.51Å; M89-I134 HydrophobicContact CE-CG1 4.24Å; M89-I134 HydrophobicContact CE-CG2 3.78Å; M89-I134 HydrophobicContact SD-CB 4.45Å; M89-I134 HydrophobicContact SD-CG2 4.14Å; N130-I134 WeakPolarHBondContact O-CG1 3.37Å; N130-I134 PolarHBondContact O-N 3.23Å; I134-L136 PolarHBondContact O-N 3.37Å; I134-I137 PolarHBondContact O-N 2.88Å; I134-T138 PolarHBondContact O-N 3.37Å; I134-T138 PolarHBondContact O-OG1 3.43Å
135T97.6Very high96.5Very high5 Ų531.3 Ų31.33%0.03119%0.19CC..Hα-helixtrans-59.9-45.6178-63.80000112F10 A82 I86 A131 A132 T133 I137 T138 L139F10-T135 HydrophobicContact CE2-CG2 4.08Å; A82-T135 HydrophobicContact CB-CG2 4.24Å; I86-T135 HydrophobicContact CD1-CG2 3.63Å; I86-T135 HydrophobicContact CG1-CG2 3.57Å; I86-T135 WeakPolarHBondContact CG1-OG1 3.37Å; A131-T135 VanDerWaalsContact O-CB 3.26Å; A131-T135 WeakPolarHBondContact O-CB 3.19Å; A131-T135 PolarHBondContact O-N 3.05Å; A131-T135 PolarHBondContact O-OG1 3.47Å; A132-T135 PolarHBondContact O-N 3.45Å; T133-T135 VanDerWaalsContact C-N 3.3Å; T133-T135 PolarHBondContact O-N 2.87Å; T135-I137 VanDerWaalsContact C-N 3.31Å; T135-I137 PolarHBondContact O-N 3.47Å; T135-T138 PolarHBondContact O-N 3.44Å; T135-L139 HydrophobicContact CG2-CD1 4.02Å; T135-L139 HydrophobicContact CG2-CG 4.43Å; T135-L139 WeakPolarHBondContact O-CB 3.47Å; T135-L139 WeakPolarHBondContact O-CG 3.23Å; T135-L139 PolarHBondContact O-N 2.88Å
136L97.9Very high96.4Very high33 Ų3327.9 Ų27.917%0.17317%0.172CC..Hα-helixtrans-62.7-40.3178.5-73.4172.3000111.2T2 F3 A132 T133 I134 L139 V140 I185T2-L136 HydrophobicContact CG2-CD2 4.36Å; T2-L136 WeakPolarHBondContact CG2-O 3.19Å; F3-L136 HydrophobicContact CD1-CD1 4.19Å; F3-L136 HydrophobicContact CD1-CD2 3.91Å; F3-L136 HydrophobicContact CE1-CD1 4.02Å; F3-L136 HydrophobicContact CE1-CD2 4.36Å; A132-L136 VanDerWaalsContact O-CG 3.32Å; A132-L136 WeakPolarHBondContact O-CG 3.48Å; A132-L136 PolarHBondContact O-N 3.21Å; T133-L136 PolarHBondContact O-N 2.89Å; I134-L136 PolarHBondContact O-N 3.37Å; L136-L139 PolarHBondContact O-N 3.05Å; L136-V140 WeakPolarHBondContact O-CG2 3.46Å; L136-V140 PolarHBondContact O-N 3.39Å; L136-I185 HydrophobicContact CB-CD1 4.48Å; L136-I185 HydrophobicContact CB-CG2 3.77Å; L136-I185 HydrophobicContact CD1-CG2 4.36Å
137I97.9Very high96.1Very high39 Ų3926.4 Ų26.420%0.216%0.162CC..Hα-helixtrans-62.9-46.9174.8-66.3169.1000110.7T133 I134 T135 L139 V140 G141 V182 I185 Q186T133-I137 HydrophobicContact CG2-CD1 4.16Å; T133-I137 WeakPolarHBondContact O-CG1 3.28Å; T133-I137 PolarHBondContact O-N 2.89Å; I134-I137 PolarHBondContact O-N 2.88Å; T135-I137 VanDerWaalsContact C-N 3.31Å; T135-I137 PolarHBondContact O-N 3.47Å; I137-L139 VanDerWaalsContact C-N 3.28Å; I137-L139 PolarHBondContact O-N 3.04Å; I137-V140 WeakPolarHBondContact O-CB 3.28Å; I137-V140 PolarHBondContact O-N 2.95Å; I137-V140 VanDerWaalsContact O-N 3.13Å; I137-G141 PolarHBondContact O-N 3.35Å; I137-V182 HydrophobicContact CD1-CG1 4.35Å; I137-V182 HydrophobicContact CG1-CG1 4.2Å; I137-V182 HydrophobicContact CG2-CG1 3.85Å; I137-V182 HydrophobicContact CG2-CG2 4.31Å; I137-I185 HydrophobicContact CD1-CG2 4.44Å; I137-I185 HydrophobicContact CG1-CB 4.26Å; I137-I185 HydrophobicContact CG1-CG2 3.79Å; I137-Q186 HydrophobicContact CD1-CB 4.2Å
138T97Very high95.7Very high54 Ų5427.5 Ų27.533%0.33117%0.169SC..Hα-helixtrans-58.5-42174.9-56.70000111.5I134 T135 V140 G141 Y142I134-T138 PolarHBondContact O-N 3.37Å; I134-T138 PolarHBondContact O-OG1 3.43Å; T135-T138 PolarHBondContact O-N 3.44Å; T138-V140 VanDerWaalsContact C-N 3.31Å; T138-V140 PolarHBondContact O-N 3.49Å; T138-G141 WeakPolarHBondContact O-CA 3.41Å; T138-G141 PolarHBondContact O-N 3.22Å; T138-G141 VanDerWaalsContact O-N 3.1Å; T138-Y142 HydrophobicContact CG2-CD1 4.24Å; T138-Y142 HydrophobicContact CG2-CD2 4.26Å; T138-Y142 HydrophobicContact CG2-CE1 3.79Å; T138-Y142 HydrophobicContact CG2-CE2 3.82Å; T138-Y142 HydrophobicContact CG2-CG 4.45Å; T138-Y142 PolarHBondContact O-N 3.27Å
139L97Very high95.2Very high1 Ų129.9 Ų29.91%0.00518%0.184CC..Hα-helixtrans-66.2-28.7177.7-79.6173.4000113.2T2 L78 A82 T135 L136 I137 G141 Y142 S143T2-L139 HydrophobicContact CG2-CB 3.66Å; L78-L139 HydrophobicContact CB-CD2 4.01Å; L78-L139 HydrophobicContact CD2-CD2 3.83Å; A82-L139 HydrophobicContact CB-CD1 4.2Å; A82-L139 HydrophobicContact CB-CD2 3.91Å; A82-L139 HydrophobicContact CB-CG 4.18Å; T135-L139 HydrophobicContact CG2-CD1 4.02Å; T135-L139 HydrophobicContact CG2-CG 4.43Å; T135-L139 WeakPolarHBondContact O-CB 3.47Å; T135-L139 WeakPolarHBondContact O-CG 3.23Å; T135-L139 PolarHBondContact O-N 2.88Å; L136-L139 PolarHBondContact O-N 3.05Å; I137-L139 VanDerWaalsContact C-N 3.28Å; I137-L139 PolarHBondContact O-N 3.04Å; L139-G141 VanDerWaalsContact C-N 3.35Å; L139-Y142 HydrophobicContact CD2-CD2 4.37Å; L139-Y142 PolarHBondContact O-N 2.89Å; L139-S143 WeakPolarHBondContact O-CB 3.31Å; L139-S143 PolarHBondContact O-N 3.4Å; L139-S143 PolarHBondContact O-OG 3.23Å
140V96.6Very high94.8Very high4 Ų429.7 Ų29.72%0.02419%0.187CC..Hα-helixtrans-60.1-48.9169.2173.70000109.5T2 L136 I137 T138 Y142 S143 A144 L178 L181 V182 I185T2-V140 HydrophobicContact CG2-CG2 3.8Å; L136-V140 WeakPolarHBondContact O-CG2 3.46Å; L136-V140 PolarHBondContact O-N 3.39Å; I137-V140 WeakPolarHBondContact O-CB 3.28Å; I137-V140 PolarHBondContact O-N 2.95Å; I137-V140 VanDerWaalsContact O-N 3.13Å; T138-V140 VanDerWaalsContact C-N 3.31Å; T138-V140 PolarHBondContact O-N 3.49Å; V140-Y142 PolarHBondContact O-N 3.4Å; V140-S143 PolarHBondContact O-N 3.41Å; V140-S143 PolarHBondContact O-OG 3.35Å; V140-A144 PolarHBondContact O-N 3.29Å; V140-A144 VanDerWaalsContact O-N 3.08Å; V140-L178 HydrophobicContact CG1-CD2 3.83Å; V140-L181 HydrophobicContact CG1-CD2 4.05Å; V140-L181 HydrophobicContact CG2-CD2 3.9Å; V140-L181 HydrophobicContact CG2-CG 4.22Å; V140-V182 HydrophobicContact CB-CG2 4.42Å; V140-V182 HydrophobicContact CG1-CG2 4.17Å; V140-I185 HydrophobicContact CG2-CD1 3.65Å
141G94.5Very high94.5Very high36 Ų3626.7 Ų26.737%0.37117%0.172SC..Hα-helixtrans-59.7-46175.700000113I137 T138 L139 S143 A144 M145I137-G141 PolarHBondContact O-N 3.35Å; T138-G141 WeakPolarHBondContact O-CA 3.41Å; T138-G141 PolarHBondContact O-N 3.22Å; T138-G141 VanDerWaalsContact O-N 3.1Å; L139-G141 VanDerWaalsContact C-N 3.35Å; G141-S143 VanDerWaalsContact C-N 3.35Å; G141-S143 PolarHBondContact O-N 3.44Å; G141-A144 WeakPolarHBondContact O-CB 3.5Å; G141-A144 PolarHBondContact O-N 3.19Å; G141-M145 PolarHBondContact O-N 3.13Å
142Y95.5Very high94.2Very high37 Ų3727.5 Ų27.515%0.14518%0.18CC..Hα-helixtrans-65.1-38.1177.3-70.3-0.1000112.4F50 L78 F85 T138 L139 V140 A144 M145 G146F50-Y142 HydrophobicContact CB-CD1 3.65Å; F50-Y142 HydrophobicContact CB-CD2 4.07Å; F50-Y142 HydrophobicContact CB-CE1 3.57Å; F50-Y142 HydrophobicContact CB-CE2 3.99Å; F50-Y142 HydrophobicContact CB-CG 3.91Å; F50-Y142 AromaticContact CD1-CD1 3.91Å; F50-Y142 HydrophobicContact CD1-CD1 3.91Å; F50-Y142 HydrophobicContact CD1-CD2 4.2Å; F50-Y142 AromaticContact CD1-CG 3.63Å; F50-Y142 HydrophobicContact CD1-CG 3.63Å; F50-Y142 HydrophobicContact CD2-CD1 4.3Å; F50-Y142 AromaticContact CD2-CD2 3.32Å; F50-Y142 HydrophobicContact CD2-CD2 3.32Å; F50-Y142 AromaticContact CD2-CE2 3.7Å; F50-Y142 HydrophobicContact CD2-CE2 3.7Å; F50-Y142 AromaticContact CD2-CG 3.66Å; F50-Y142 HydrophobicContact CD2-CG 3.66Å; F50-Y142 HydrophobicContact CE1-CG 4.1Å; F50-Y142 WeakPolarHBondContact CE1-O 3.36Å; F50-Y142 AromaticContact CE2-CD2 3.78Å; F50-Y142 HydrophobicContact CE2-CD2 3.78Å; F50-Y142 HydrophobicContact CE2-CG 4.12Å; F50-Y142 AromaticContact CG-CD1 3.66Å; F50-Y142 HydrophobicContact CG-CD1 3.66Å; F50-Y142 AromaticContact CG-CD2 3.56Å; F50-Y142 HydrophobicContact CG-CD2 3.56Å; F50-Y142 HydrophobicContact CG-CE1 4.05Å; F50-Y142 AromaticContact CG-CE2 3.95Å; F50-Y142 HydrophobicContact CG-CE2 3.95Å; F50-Y142 AromaticContact CG-CG 3.4Å; F50-Y142 HydrophobicContact CG-CG 3.4Å; F50-Y142 VanDerWaalsContact CG-CG 3.4Å; F50-Y142 HydrophobicContact CZ-CD2 4.4Å; F50-Y142 HydrophobicContact CZ-CG 4.33Å; L78-Y142 VanDerWaalsContact CD2-CB 3.45Å; F85-Y142 WeakPolarHBondContact CE2-OH 3.48Å; T138-Y142 HydrophobicContact CG2-CD1 4.24Å; T138-Y142 HydrophobicContact CG2-CD2 4.26Å; T138-Y142 HydrophobicContact CG2-CE1 3.79Å; T138-Y142 HydrophobicContact CG2-CE2 3.82Å; T138-Y142 HydrophobicContact CG2-CG 4.45Å; T138-Y142 PolarHBondContact O-N 3.27Å; L139-Y142 HydrophobicContact CD2-CD2 4.37Å; L139-Y142 PolarHBondContact O-N 2.89Å; V140-Y142 PolarHBondContact O-N 3.4Å; Y142-A144 PolarHBondContact O-N 2.81Å; Y142-M145 HydrophobicContact CD1-SD 4.39Å; Y142-M145 WeakPolarHBondContact O-CB 3.17Å; Y142-M145 PolarHBondContact O-N 3.33Å; Y142-M145 VanDerWaalsContact O-N 3.17Å; Y142-G146 PolarHBondContact O-N 3.46Å
143S94.1Very high93.9Very high14 Ų1428.2 Ų28.210%0.09819%0.19CC..Hα-helixtrans-64.1-31.7176.176.40000112.1L139 V140 G141 G146 G147L139-S143 WeakPolarHBondContact O-CB 3.31Å; L139-S143 PolarHBondContact O-N 3.4Å; L139-S143 PolarHBondContact O-OG 3.23Å; V140-S143 PolarHBondContact O-N 3.41Å; V140-S143 PolarHBondContact O-OG 3.35Å; G141-S143 VanDerWaalsContact C-N 3.35Å; G141-S143 PolarHBondContact O-N 3.44Å; S143-G146 PolarHBondContact O-N 3.39Å; S143-G147 PolarHBondContact O-N 3.44Å
144A93Very high93.7Very high29 Ų2930.4 Ų30.424%0.2420%0.201CC..Hα-helixtrans-66.8-41.7174.400000111.5V140 G141 Y142 G146 G147 A148V140-A144 PolarHBondContact O-N 3.29Å; V140-A144 VanDerWaalsContact O-N 3.08Å; G141-A144 WeakPolarHBondContact O-CB 3.5Å; G141-A144 PolarHBondContact O-N 3.19Å; Y142-A144 PolarHBondContact O-N 2.81Å; A144-G146 VanDerWaalsContact C-N 3.3Å; A144-G146 PolarHBondContact O-N 2.89Å; A144-G147 PolarHBondContact O-N 3.46Å; A144-G147 VanDerWaalsContact O-N 3.12Å; A144-A148 PolarHBondContact O-N 3.17Å
145M93.4Very high93.5Very high75 Ų7528 Ų2837%0.36919%0.192SC..Hα-helixtrans-61.9-39.1171.3-58.6177.2-172.100111.4F50 I51 G141 Y142 G147 A148F50-M145 HydrophobicContact CB-SD 4.18Å; F50-M145 HydrophobicContact CD1-CB 4.07Å; F50-M145 HydrophobicContact CD1-SD 3.85Å; F50-M145 HydrophobicContact CE1-CB 4.32Å; F50-M145 HydrophobicContact CG-SD 4.5Å; I51-M145 HydrophobicContact CB-SD 4.38Å; G141-M145 PolarHBondContact O-N 3.13Å; Y142-M145 HydrophobicContact CD1-SD 4.39Å; Y142-M145 WeakPolarHBondContact O-CB 3.17Å; Y142-M145 PolarHBondContact O-N 3.33Å; Y142-M145 VanDerWaalsContact O-N 3.17Å; M145-G147 VanDerWaalsContact C-N 3.29Å; M145-G147 PolarHBondContact O-N 3.28Å; M145-A148 WeakPolarHBondContact O-CB 3.07Å; M145-A148 PolarHBondContact O-N 3.34Å
146G92.9Very high93.4Very high0 Ų030 Ų300%020%0.201CC..Hα-helixtrans-60-38.2172.300000112.8Y142 S143 A144 A148 V149 G150 A151Y142-G146 PolarHBondContact O-N 3.46Å; S143-G146 PolarHBondContact O-N 3.39Å; A144-G146 VanDerWaalsContact C-N 3.3Å; A144-G146 PolarHBondContact O-N 2.89Å; G146-A148 PolarHBondContact O-N 2.9Å; G146-V149 WeakPolarHBondContact O-CG2 3.43Å; G146-V149 PolarHBondContact O-N 3.49Å; G146-G150 PolarHBondContact O-N 3.47Å; G146-A151 WeakPolarHBondContact O-CB 3.19Å; G146-A151 PolarHBondContact O-N 3.4Å
147G91.8Very high93.2Very high1 Ų132 Ų321%0.0121%0.211CC..Hα-helixtrans-57-34.6175.500000113.1S143 A144 M145 V149 G150 G152 Q156S143-G147 PolarHBondContact O-N 3.44Å; A144-G147 PolarHBondContact O-N 3.46Å; A144-G147 VanDerWaalsContact O-N 3.12Å; M145-G147 VanDerWaalsContact C-N 3.29Å; M145-G147 PolarHBondContact O-N 3.28Å; G147-V149 PolarHBondContact O-N 2.8Å; G147-G150 PolarHBondContact O-N 2.91Å; G147-G152 WeakPolarHBondContact CA-O 3.42Å; G147-Q156 WeakPolarHBondContact O-CB 3.49Å
148A86.9Confident93.1Very high45 Ų4530.5 Ų30.537%0.37221%0.205SC..Hα-helixtrans-67.5-22.3177.400000113.6A144 M145 G146A144-A148 PolarHBondContact O-N 3.17Å; M145-A148 WeakPolarHBondContact O-CB 3.07Å; M145-A148 PolarHBondContact O-N 3.34Å; G146-A148 PolarHBondContact O-N 2.9Å
149V86.9Confident93Very high67 Ų6732.6 Ų32.641%0.40621%0.207SC..THydrogen-bonded Turntrans-103.215.8175.9-58.90000113.1L54 G146 G147L54-V149 HydrophobicContact CD1-CG2 3.92Å; L54-V149 HydrophobicContact CD2-CB 3.97Å; L54-V149 HydrophobicContact CD2-CG1 3.6Å; L54-V149 HydrophobicContact CD2-CG2 3.31Å; L54-V149 HydrophobicContact CG-CG2 4.1Å; G146-V149 WeakPolarHBondContact O-CG2 3.43Å; G146-V149 PolarHBondContact O-N 3.49Å; G147-V149 PolarHBondContact O-N 2.8Å
150G88.9Confident92.9Very high19 Ų1936 Ų3620%0.19622%0.223CC..THydrogen-bonded Turntrans8625.5177.400000115I69 G70 G146 G147 G152I69-G150 WeakPolarHBondContact CG2-O 3.31Å; G70-G150 VanDerWaalsContact CA-O 3.31Å; G70-G150 WeakPolarHBondContact CA-O 3.45Å; G70-G150 PolarHBondContact N-O 3.07Å; G146-G150 PolarHBondContact O-N 3.47Å; G147-G150 PolarHBondContact O-N 2.91Å; G150-G152 PolarHBondContact O-N 3.1Å
151A90.9Very high92.9Very high5 Ų542.8 Ų42.84%0.04125%0.249CC..  trans-71.3-14.7170.100000114M1 L71 A74 G146M1-A151 HydrophobicContact CE-CB 4.31Å; M1-A151 HydrophobicContact SD-CB 4.15Å; L71-A151 PolarHBondContact N-O 3.39Å; A74-A151 HydrophobicContact CB-CB 3.36Å; G146-A151 WeakPolarHBondContact O-CB 3.19Å; G146-A151 PolarHBondContact O-N 3.4Å
152G91.7Very high93Very high19 Ų1941.2 Ų41.220%0.19623%0.233CC..  trans82.5-162.8-169.200000113.8M1 G147 G150M1-G152 WeakPolarHBondContact CE-O 3.46Å; G147-G152 WeakPolarHBondContact CA-O 3.42Å; G150-G152 PolarHBondContact O-N 3.1Å
153G92.5Very high93Very high41 Ų4146.6 Ų46.642%0.42325%0.254SS..Hα-helixtrans75-169.5177.700000114.6G155 Q156 I157G153-G155 VanDerWaalsContact C-N 3.28Å; G153-G155 PolarHBondContact O-N 3.08Å; G153-Q156 PolarHBondContact O-N 3.13Å; G153-I157 PolarHBondContact O-N 3.04Å
154L91.9Very high93.1Very high53 Ų5350.2 Ų50.228%0.27727%0.272SS..Hα-helixtrans-60.5-35.9-175.2-67.1177.8000112.8Q156 I157 G158 V174 L177 L178L154-Q156 PolarHBondContact O-N 3.37Å; L154-I157 PolarHBondContact O-N 2.71Å; L154-G158 PolarHBondContact O-N 3.31Å; L154-V174 HydrophobicContact CB-CG1 4.31Å; L154-V174 WeakPolarHBondContact O-CG1 3.4Å; L154-L177 HydrophobicContact CD1-CB 4.18Å; L154-L177 HydrophobicContact CD2-CD1 4.06Å; L154-L178 HydrophobicContact CB-CD2 4Å; L154-L178 HydrophobicContact CB-CG 4.47Å; L154-L178 HydrophobicContact CD1-CD2 3.8Å; L154-L178 HydrophobicContact CD1-CG 4.29Å
155G94.2Very high93.2Very high12 Ų1251.1 Ų51.112%0.12428%0.284CS..Hα-helixtrans-61.5-41.6176.700000113.1G153 G158 Y159G153-G155 VanDerWaalsContact C-N 3.28Å; G153-G155 PolarHBondContact O-N 3.08Å; G155-G158 PolarHBondContact O-N 3.36Å; G155-Y159 WeakPolarHBondContact O-CB 3.49Å; G155-Y159 PolarHBondContact O-N 3.2Å
156Q95Very high93.4Very high47 Ų4757.3 Ų57.322%0.2230%0.304CS..Hα-helixtrans-66.4-41.8177.1-175.4174.1-41.100111.1G147 G153 L154 Y159 Q160G147-Q156 WeakPolarHBondContact O-CB 3.49Å; G153-Q156 PolarHBondContact O-N 3.13Å; L154-Q156 PolarHBondContact O-N 3.37Å; Q156-Y159 PolarHBondContact O-N 3.21Å; Q156-Q160 VanDerWaalsContact CG-CD 3.42Å; Q156-Q160 HydrophobicContact CG-CG 4.03Å; Q156-Q160 WeakPolarHBondContact O-CB 3.34Å; Q156-Q160 WeakPolarHBondContact O-CG 3.32Å; Q156-Q160 PolarHBondContact O-N 3.41Å
157I95.7Very high93.6Very high75 Ų7560.5 Ų60.539%0.38532%0.321SS..Hα-helixtrans-62.5-46.8178.1-63170.6000110.4G153 L154 Y159 Y161 G162 V170 V174G153-I157 PolarHBondContact O-N 3.04Å; L154-I157 PolarHBondContact O-N 2.71Å; I157-Y159 VanDerWaalsContact C-N 3.3Å; I157-Y159 PolarHBondContact O-N 3.26Å; I157-Y161 HydrophobicContact CG2-CD2 4.16Å; I157-Y161 WeakPolarHBondContact O-CB 3.37Å; I157-Y161 PolarHBondContact O-N 2.97Å; I157-G162 PolarHBondContact O-N 3.39Å; I157-V170 HydrophobicContact CG2-CG1 4.22Å; I157-V174 HydrophobicContact CB-CG2 4.29Å; I157-V174 HydrophobicContact CG2-CG2 3.85Å
158G95.7Very high93.9Very high6 Ų663.7 Ų63.76%0.06235%0.348CS..Iπ-helixtrans-60.7-39.7176.900000112.3L154 G155 G162 Y163L154-G158 PolarHBondContact O-N 3.31Å; G155-G158 PolarHBondContact O-N 3.36Å; G158-G162 CarbonylContact O-C 3.48Å; G158-G162 WeakPolarHBondContact O-CA 3.37Å; G158-G162 PolarHBondContact O-N 2.94Å; G158-Y163 PolarHBondContact O-N 3.19Å
159Y94.8Very high94.4Very high98 Ų9866.5 Ų66.538%0.38436%0.36SS..Iπ-helixtrans-72.5-52.1178.7-178.1-112.8000113.1G155 Q156 I157 Y163 I164G155-Y159 WeakPolarHBondContact O-CB 3.49Å; G155-Y159 PolarHBondContact O-N 3.2Å; Q156-Y159 PolarHBondContact O-N 3.21Å; I157-Y159 VanDerWaalsContact C-N 3.3Å; I157-Y159 PolarHBondContact O-N 3.26Å; Y159-Y163 HydrophobicContact CD2-CD1 4.05Å; Y159-Y163 AromaticContact CE2-CD1 3.85Å; Y159-Y163 HydrophobicContact CE2-CD1 3.85Å; Y159-Y163 HydrophobicContact CE2-CE1 4.33Å; Y159-Y163 WeakPolarHBondContact O-CB 3.41Å; Y159-Y163 PolarHBondContact O-N 2.95Å; Y159-I164 HydrophobicContact CD1-CD1 3.83Å; Y159-I164 HydrophobicContact CE1-CD1 3.33Å; Y159-I164 HydrophobicContact CE1-CG1 4.3Å; Y159-I164 HydrophobicContact CE2-CD1 4.24Å; Y159-I164 HydrophobicContact CE2-CG1 4.39Å; Y159-I164 HydrophobicContact CG-CD1 4.48Å; Y159-I164 PolarHBondContact O-N 2.99Å
160Q95.1Very high94.9Very high74 Ų7465.1 Ų65.135%0.34635%0.352SS..Iπ-helixtrans-76.2-50.3-173.1-68.8179.1-13.200112.4Q156 I164 G165Q156-Q160 VanDerWaalsContact CG-CD 3.42Å; Q156-Q160 HydrophobicContact CG-CG 4.03Å; Q156-Q160 WeakPolarHBondContact O-CB 3.34Å; Q156-Q160 WeakPolarHBondContact O-CG 3.32Å; Q156-Q160 PolarHBondContact O-N 3.41Å; Q160-I164 WeakPolarHBondContact O-CB 3.44Å; Q160-G165 PolarHBondContact O-N 3.38Å
161Y95.7Very high95.3Very high146 Ų14668.4 Ų68.457%0.57336%0.364SS*.Iπ-helixtrans-93.6-26.4-174.6-60-74.5000112.6I157 N167I157-Y161 HydrophobicContact CG2-CD2 4.16Å; I157-Y161 WeakPolarHBondContact O-CB 3.37Å; I157-Y161 PolarHBondContact O-N 2.97Å; Y161-N167 VanDerWaalsContact O-CB 3.29Å; Y161-N167 WeakPolarHBondContact O-CB 3.2Å
162G96.3Very high95.6Very high3 Ų372.8 Ų72.83%0.03139%0.386CS..Iπ-helixtrans-83.6-69.8174.900000112.3I157 G158 Y166 N167I157-G162 PolarHBondContact O-N 3.39Å; G158-G162 CarbonylContact O-C 3.48Å; G158-G162 WeakPolarHBondContact O-CA 3.37Å; G158-G162 PolarHBondContact O-N 2.94Å; G162-Y166 CarbonylContact O-C 3.22Å; G162-Y166 WeakPolarHBondContact O-CA 3.2Å; G162-Y166 PolarHBondContact O-N 2.86Å; G162-N167 PolarHBondContact O-N 3.35Å
163Y96.2Very high95.9Very high150 Ų15075.4 Ų75.459%0.58840%0.399SS*.Iπ-helixtrans-72.5-59.6-173.5178.3-106.1000113.1G158 Y159 G165 Y166G158-Y163 PolarHBondContact O-N 3.19Å; Y159-Y163 HydrophobicContact CD2-CD1 4.05Å; Y159-Y163 AromaticContact CE2-CD1 3.85Å; Y159-Y163 HydrophobicContact CE2-CD1 3.85Å; Y159-Y163 HydrophobicContact CE2-CE1 4.33Å; Y159-Y163 WeakPolarHBondContact O-CB 3.41Å; Y159-Y163 PolarHBondContact O-N 2.95Å; Y163-G165 VanDerWaalsContact C-N 3.33Å; Y163-G165 PolarHBondContact O-N 2.92Å; Y163-Y166 PolarHBondContact O-N 3.25Å; Y163-Y166 VanDerWaalsContact O-N 3.1Å
164I96.7Very high96.1Very high90 Ų9073.9 Ų73.946%0.46238%0.381SS..Iπ-helixtrans-64.9-39.9179.5-68169.8000110.8Y159 Q160 Y166Y159-I164 HydrophobicContact CD1-CD1 3.83Å; Y159-I164 HydrophobicContact CE1-CD1 3.33Å; Y159-I164 HydrophobicContact CE1-CG1 4.3Å; Y159-I164 HydrophobicContact CE2-CD1 4.24Å; Y159-I164 HydrophobicContact CE2-CG1 4.39Å; Y159-I164 HydrophobicContact CG-CD1 4.48Å; Y159-I164 PolarHBondContact O-N 2.99Å; Q160-I164 WeakPolarHBondContact O-CB 3.44Å; I164-Y166 WeakPolarHBondContact O-CD2 3.4Å; I164-Y166 PolarHBondContact O-N 3.37Å
165G95.2Very high96.3Very high48 Ų4875.7 Ų75.750%0.49539%0.391SS..THydrogen-bonded Turntrans-70.9-3.4175.700000114.7Q160 Y163 N167Q160-G165 PolarHBondContact O-N 3.38Å; Y163-G165 VanDerWaalsContact C-N 3.33Å; Y163-G165 PolarHBondContact O-N 2.92Å; G165-N167 PolarHBondContact O-N 3.15Å; G165-N167 VanDerWaalsContact O-N 3.08Å
166Y96.3Very high96.5Very high204 Ų20478.9 Ų78.980%0.841%0.407SS*.THydrogen-bonded Turntrans48.333.5-174.2-65.6-84.6000113.6G162 Y163 I164G162-Y166 CarbonylContact O-C 3.22Å; G162-Y166 WeakPolarHBondContact O-CA 3.2Å; G162-Y166 PolarHBondContact O-N 2.86Å; Y163-Y166 PolarHBondContact O-N 3.25Å; Y163-Y166 VanDerWaalsContact O-N 3.1Å; I164-Y166 WeakPolarHBondContact O-CD2 3.4Å; I164-Y166 PolarHBondContact O-N 3.37Å
167N97.4Very high96.7Very high67 Ų6780.4 Ų80.436%0.35842%0.417SS..  trans-103.496.6-177-169.5-36.6000110.4Y161 G162 G165 T169 V170 M171Y161-N167 VanDerWaalsContact O-CB 3.29Å; Y161-N167 WeakPolarHBondContact O-CB 3.2Å; G162-N167 PolarHBondContact O-N 3.35Å; G165-N167 PolarHBondContact O-N 3.15Å; G165-N167 VanDerWaalsContact O-N 3.08Å; N167-T169 PolarHBondContact O-N 2.96Å; N167-T169 WeakPolarHBondContact OD1-CB 3.47Å; N167-T169 PolarHBondContact OD1-N 3.45Å; N167-T169 VanDerWaalsContact OD1-N 3.09Å; N167-V170 HydrophobicContact CB-CB 4.18Å; N167-V170 HydrophobicContact CB-CG2 4.14Å; N167-V170 PolarHBondContact O-N 3.33Å; N167-V170 PolarHBondContact OD1-N 3.03Å; N167-M171 PolarHBondContact O-N 3.42Å
168A97.1Very high96.7Very high68 Ų6878.9 Ų78.956%0.56241%0.409SS*.Hα-helixtrans-59.8-34.1179.400000112.8M171 N172A168-M171 PolarHBondContact O-N 3.12Å; A168-N172 WeakPolarHBondContact O-CB 3.35Å; A168-N172 PolarHBondContact O-N 3.25Å; A168-N172 PolarHBondContact O-ND2 3.2Å
169T98.1Very high96.8Very high104 Ų10481.8 Ų81.864%0.63843%0.425SS*.Hα-helixtrans-62.5-50.2177.4-54.20000110.6N167 M171 N172 T173N167-T169 PolarHBondContact O-N 2.96Å; N167-T169 WeakPolarHBondContact OD1-CB 3.47Å; N167-T169 PolarHBondContact OD1-N 3.45Å; N167-T169 VanDerWaalsContact OD1-N 3.09Å; T169-M171 PolarHBondContact O-N 2.91Å; T169-N172 PolarHBondContact O-N 3.2Å; T169-T173 PolarHBondContact O-N 3.47Å; T169-T173 PolarHBondContact O-OG1 3.4Å
170V97.3Very high96.9Very high39 Ų3981.2 Ų81.224%0.23643%0.428CS..Hα-helixtrans-62.6-43.1178.2175.10000111.2I157 N167 N172 T173 V174I157-V170 HydrophobicContact CG2-CG1 4.22Å; N167-V170 HydrophobicContact CB-CB 4.18Å; N167-V170 HydrophobicContact CB-CG2 4.14Å; N167-V170 PolarHBondContact O-N 3.33Å; N167-V170 PolarHBondContact OD1-N 3.03Å; V170-N172 PolarHBondContact O-N 3.25Å; V170-T173 PolarHBondContact O-N 3.18Å; V170-V174 HydrophobicContact CG1-CG2 4.49Å; V170-V174 WeakPolarHBondContact O-CG2 3.23Å; V170-V174 PolarHBondContact O-N 3.45Å
171M96.9Very high97Very high88 Ų8880.1 Ų80.143%0.43342%0.424SS..Hα-helixtrans-58.7-47.3177.3-176.161.2-178.500111.8N167 A168 T169 V174 L175N167-M171 PolarHBondContact O-N 3.42Å; A168-M171 PolarHBondContact O-N 3.12Å; T169-M171 PolarHBondContact O-N 2.91Å; M171-V174 PolarHBondContact O-N 3.47Å; M171-L175 PolarHBondContact O-N 3.26Å
172N97.9Very high97.1Very high96 Ų9675.2 Ų75.251%0.51341%0.409SS..Hα-helixtrans-66.4-38.7178.3-71.9-27000112.1A168 T169 V170 L175 V176A168-N172 WeakPolarHBondContact O-CB 3.35Å; A168-N172 PolarHBondContact O-N 3.25Å; A168-N172 PolarHBondContact O-ND2 3.2Å; T169-N172 PolarHBondContact O-N 3.2Å; V170-N172 PolarHBondContact O-N 3.25Å; N172-L175 PolarHBondContact O-N 2.91Å; N172-V176 WeakPolarHBondContact O-CG2 3.05Å; N172-V176 PolarHBondContact O-N 3.25Å
173T98Very high97.2Very high75 Ų7582.9 Ų82.946%0.4644%0.439SS..Hα-helixtrans-60.8-47174.4-57.80000111.3T169 V170 L175 V176 L177T169-T173 PolarHBondContact O-N 3.47Å; T169-T173 PolarHBondContact O-OG1 3.4Å; V170-T173 PolarHBondContact O-N 3.18Å; T173-L175 VanDerWaalsContact C-N 3.34Å; T173-L175 PolarHBondContact O-N 3.3Å; T173-V176 PolarHBondContact O-N 2.93Å; T173-L177 HydrophobicContact CG2-CD1 4.16Å; T173-L177 HydrophobicContact CG2-CG 4.48Å; T173-L177 VanDerWaalsContact O-CG 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.42Å; T173-L177 PolarHBondContact O-N 3.31Å
174V96.9Very high97.3Very high9 Ų980.8 Ų80.86%0.05544%0.437CS..Hα-helixtrans-62.2-42.1177.9171.20000111.3L154 I157 V170 M171 L177 L178L154-V174 HydrophobicContact CB-CG1 4.31Å; L154-V174 WeakPolarHBondContact O-CG1 3.4Å; I157-V174 HydrophobicContact CB-CG2 4.29Å; I157-V174 HydrophobicContact CG2-CG2 3.85Å; V170-V174 HydrophobicContact CG1-CG2 4.49Å; V170-V174 WeakPolarHBondContact O-CG2 3.23Å; V170-V174 PolarHBondContact O-N 3.45Å; M171-V174 PolarHBondContact O-N 3.47Å; V174-L177 PolarHBondContact O-N 3.18Å; V174-L178 HydrophobicContact CG1-CD1 4.07Å; V174-L178 HydrophobicContact CG1-CG 4.39Å; V174-L178 WeakPolarHBondContact O-CG 3.46Å; V174-L178 PolarHBondContact O-N 3.31Å
175L96.9Very high97.4Very high91 Ų9177 Ų7748%0.47642%0.418SS..Hα-helixtrans-58.1-50175.6-176154.5000111.3M171 N172 T173 L177 L178 V179M171-L175 PolarHBondContact O-N 3.26Å; N172-L175 PolarHBondContact O-N 2.91Å; T173-L175 VanDerWaalsContact C-N 3.34Å; T173-L175 PolarHBondContact O-N 3.3Å; L175-L177 VanDerWaalsContact C-N 3.33Å; L175-L177 PolarHBondContact O-N 3.34Å; L175-L178 PolarHBondContact O-N 3.46Å; L175-V179 HydrophobicContact CD2-CG2 4.06Å; L175-V179 WeakPolarHBondContact O-CG2 3.42Å; L175-V179 PolarHBondContact O-N 3.42Å
176V98.2Very high97.5Very high78 Ų7877.8 Ų77.847%0.47341%0.408SS..Hα-helixtrans-60-43.2178.1170.50000111.1N172 T173 L178 V179 I180N172-V176 WeakPolarHBondContact O-CG2 3.05Å; N172-V176 PolarHBondContact O-N 3.25Å; T173-V176 PolarHBondContact O-N 2.93Å; V176-L178 PolarHBondContact O-N 3.22Å; V176-V179 PolarHBondContact O-N 2.89Å; V176-I180 HydrophobicContact CG1-CD1 3.73Å; V176-I180 HydrophobicContact CG1-CG1 4.36Å; V176-I180 VanDerWaalsContact O-CG1 3.29Å; V176-I180 WeakPolarHBondContact O-CG1 3.5Å; V176-I180 PolarHBondContact O-N 3.3Å
177L97.6Very high97.6Very high80 Ų8073.2 Ų73.242%0.41939%0.393SS..Hα-helixtrans-62.6-40.2177.1-70.5175000112.6L154 T173 V174 L175 L181L154-L177 HydrophobicContact CD1-CB 4.18Å; L154-L177 HydrophobicContact CD2-CD1 4.06Å; T173-L177 HydrophobicContact CG2-CD1 4.16Å; T173-L177 HydrophobicContact CG2-CG 4.48Å; T173-L177 VanDerWaalsContact O-CG 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.42Å; T173-L177 PolarHBondContact O-N 3.31Å; V174-L177 PolarHBondContact O-N 3.18Å; L175-L177 VanDerWaalsContact C-N 3.33Å; L175-L177 PolarHBondContact O-N 3.34Å; L177-L181 WeakPolarHBondContact O-CB 3.36Å; L177-L181 PolarHBondContact O-N 2.95Å
178L96.2Very high97.6Very high42 Ų4272.3 Ų72.322%0.2239%0.394CS..Hα-helixtrans-65.6-42.9175.5-71.9173.1000111.6V140 L154 V174 L175 V176 L181 V182V140-L178 HydrophobicContact CG1-CD2 3.83Å; L154-L178 HydrophobicContact CB-CD2 4Å; L154-L178 HydrophobicContact CB-CG 4.47Å; L154-L178 HydrophobicContact CD1-CD2 3.8Å; L154-L178 HydrophobicContact CD1-CG 4.29Å; V174-L178 HydrophobicContact CG1-CD1 4.07Å; V174-L178 HydrophobicContact CG1-CG 4.39Å; V174-L178 WeakPolarHBondContact O-CG 3.46Å; V174-L178 PolarHBondContact O-N 3.31Å; L175-L178 PolarHBondContact O-N 3.46Å; V176-L178 PolarHBondContact O-N 3.22Å; L178-L181 PolarHBondContact O-N 2.96Å; L178-V182 WeakPolarHBondContact O-CG2 3.3Å; L178-V182 PolarHBondContact O-N 3.3Å
179V97.9Very high97.6Very high67 Ų6769.2 Ų69.241%0.40637%0.369SS..Hα-helixtrans-60.3-50.2175.8171.40000110.2L175 V176 L181 V182 Y183L175-V179 HydrophobicContact CD2-CG2 4.06Å; L175-V179 WeakPolarHBondContact O-CG2 3.42Å; L175-V179 PolarHBondContact O-N 3.42Å; V176-V179 PolarHBondContact O-N 2.89Å; V179-L181 VanDerWaalsContact C-N 3.33Å; V179-L181 PolarHBondContact O-N 2.82Å; V179-V182 PolarHBondContact O-N 2.94Å; V179-Y183 HydrophobicContact CG1-CD2 3.64Å; V179-Y183 HydrophobicContact CG1-CE2 3.67Å; V179-Y183 VanDerWaalsContact O-CD2 3.32Å; V179-Y183 WeakPolarHBondContact O-CD2 3.38Å; V179-Y183 PolarHBondContact O-N 2.95Å
180I98.2Very high97.5Very high86 Ų8667.1 Ų67.144%0.44135%0.354SS..Hα-helixtrans-56.8-47.2177-69.4168.7000110.7V176 V182 Y183 L184V176-I180 HydrophobicContact CG1-CD1 3.73Å; V176-I180 HydrophobicContact CG1-CG1 4.36Å; V176-I180 VanDerWaalsContact O-CG1 3.29Å; V176-I180 WeakPolarHBondContact O-CG1 3.5Å; V176-I180 PolarHBondContact O-N 3.3Å; I180-V182 VanDerWaalsContact C-N 3.33Å; I180-V182 PolarHBondContact O-N 3.41Å; I180-Y183 PolarHBondContact O-N 3.01Å; I180-L184 HydrophobicContact CG2-CD1 3.93Å; I180-L184 HydrophobicContact CG2-CG 4.25Å; I180-L184 VanDerWaalsContact O-CG 3.28Å; I180-L184 WeakPolarHBondContact O-CG 3.36Å; I180-L184 PolarHBondContact O-N 3.37Å
181L96.8Very high97.4Very high52 Ų5272.7 Ų72.727%0.27237%0.371SS..Hα-helixtrans-58.6-43.8178.9178.461.9000112.1V140 L177 L178 V179 L184 I185V140-L181 HydrophobicContact CG1-CD2 4.05Å; V140-L181 HydrophobicContact CG2-CD2 3.9Å; V140-L181 HydrophobicContact CG2-CG 4.22Å; L177-L181 WeakPolarHBondContact O-CB 3.36Å; L177-L181 PolarHBondContact O-N 2.95Å; L178-L181 PolarHBondContact O-N 2.96Å; V179-L181 VanDerWaalsContact C-N 3.33Å; V179-L181 PolarHBondContact O-N 2.82Å; L181-L184 PolarHBondContact O-N 3.47Å; L181-I185 HydrophobicContact CD1-CD1 4.24Å; L181-I185 HydrophobicContact CG-CD1 4.17Å; L181-I185 WeakPolarHBondContact O-CG1 3.29Å; L181-I185 PolarHBondContact O-N 2.96Å
182V98Very high97.4Very high42 Ų4272.8 Ų72.826%0.25537%0.372SS..Hα-helixtrans-64-46.1177.4168.40000111.2I137 V140 L178 V179 I180 L184 I185 Q186I137-V182 HydrophobicContact CD1-CG1 4.35Å; I137-V182 HydrophobicContact CG1-CG1 4.2Å; I137-V182 HydrophobicContact CG2-CG1 3.85Å; I137-V182 HydrophobicContact CG2-CG2 4.31Å; V140-V182 HydrophobicContact CB-CG2 4.42Å; V140-V182 HydrophobicContact CG1-CG2 4.17Å; L178-V182 WeakPolarHBondContact O-CG2 3.3Å; L178-V182 PolarHBondContact O-N 3.3Å; V179-V182 PolarHBondContact O-N 2.94Å; I180-V182 VanDerWaalsContact C-N 3.33Å; I180-V182 PolarHBondContact O-N 3.41Å; V182-L184 VanDerWaalsContact C-N 3.31Å; V182-L184 PolarHBondContact O-N 3.46Å; V182-I185 PolarHBondContact O-N 3.27Å; V182-Q186 WeakPolarHBondContact O-CB 3.35Å; V182-Q186 PolarHBondContact O-N 3.45Å
183Y98.1Very high97.2Very high165 Ų16569.6 Ų69.665%0.64736%0.356SS*.Hα-helixtrans-62.1-37.9176.7-88.1-79000112.5V179 I180 Q186 F187V179-Y183 HydrophobicContact CG1-CD2 3.64Å; V179-Y183 HydrophobicContact CG1-CE2 3.67Å; V179-Y183 VanDerWaalsContact O-CD2 3.32Å; V179-Y183 WeakPolarHBondContact O-CD2 3.38Å; V179-Y183 PolarHBondContact O-N 2.95Å; I180-Y183 PolarHBondContact O-N 3.01Å; Y183-Q186 PolarHBondContact O-N 3.37Å; Y183-F187 WeakPolarHBondContact O-CB 3.48Å; Y183-F187 PolarHBondContact O-N 2.92Å
184L98.2Very high97Very high105 Ų10574.5 Ų74.555%0.5537%0.366SS..Hα-helixtrans-62.6-43.7174.7-72.2174.5000111.7I180 L181 V182 A188I180-L184 HydrophobicContact CG2-CD1 3.93Å; I180-L184 HydrophobicContact CG2-CG 4.25Å; I180-L184 VanDerWaalsContact O-CG 3.28Å; I180-L184 WeakPolarHBondContact O-CG 3.36Å; I180-L184 PolarHBondContact O-N 3.37Å; L181-L184 PolarHBondContact O-N 3.47Å; V182-L184 VanDerWaalsContact C-N 3.31Å; V182-L184 PolarHBondContact O-N 3.46Å; L184-A188 WeakPolarHBondContact O-CB 3.34Å; L184-A188 PolarHBondContact O-N 3.01Å
185I97.9Very high96.9Very high12 Ų1277.2 Ų77.26%0.06239%0.389CS..Hα-helixtrans-64.1-48.1176.4-66.9165.7000110.4F3 T133 L136 I137 V140 L181 V182 F187 A188 G189F3-I185 HydrophobicContact CZ-CG1 4.35Å; T133-I185 HydrophobicContact CG2-CG2 4.3Å; L136-I185 HydrophobicContact CB-CD1 4.48Å; L136-I185 HydrophobicContact CB-CG2 3.77Å; L136-I185 HydrophobicContact CD1-CG2 4.36Å; I137-I185 HydrophobicContact CD1-CG2 4.44Å; I137-I185 HydrophobicContact CG1-CB 4.26Å; I137-I185 HydrophobicContact CG1-CG2 3.79Å; V140-I185 HydrophobicContact CG2-CD1 3.65Å; L181-I185 HydrophobicContact CD1-CD1 4.24Å; L181-I185 HydrophobicContact CG-CD1 4.17Å; L181-I185 WeakPolarHBondContact O-CG1 3.29Å; L181-I185 PolarHBondContact O-N 2.96Å; V182-I185 PolarHBondContact O-N 3.27Å; I185-F187 PolarHBondContact O-N 3.3Å; I185-A188 PolarHBondContact O-N 3.31Å; I185-G189 PolarHBondContact O-N 2.98Å
186Q98Very high96.6Very high63 Ų6374.4 Ų74.429%0.29438%0.376SS..Hα-helixtrans-57.8-50.1178.8-175.766.550.300111.1I137 V182 Y183 A188 G189 D190I137-Q186 HydrophobicContact CD1-CB 4.2Å; V182-Q186 WeakPolarHBondContact O-CB 3.35Å; V182-Q186 PolarHBondContact O-N 3.45Å; Y183-Q186 PolarHBondContact O-N 3.37Å; Q186-A188 PolarHBondContact O-N 2.87Å; Q186-G189 PolarHBondContact O-N 3.39Å; Q186-G189 VanDerWaalsContact O-N 3.15Å; Q186-D190 PolarHBondContact NE2-OD1 3.22Å; Q186-D190 VanDerWaalsContact O-CG 3.26Å; Q186-D190 PolarHBondContact O-N 3.18Å
187F97.8Very high96.1Very high109 Ų10974.6 Ų74.648%0.47838%0.377SS..Hα-helixtrans-63.1-41.1-178.6-178.1-113000112.8Y183 I185 R191Y183-F187 WeakPolarHBondContact O-CB 3.48Å; Y183-F187 PolarHBondContact O-N 2.92Å; I185-F187 PolarHBondContact O-N 3.3Å; F187-R191 WeakPolarHBondContact O-CB 3.36Å; F187-R191 WeakPolarHBondContact O-CG 3.37Å; F187-R191 PolarHBondContact O-N 3.46Å; F187-R191 VanDerWaalsContact O-N 3.09Å
188A97.3Very high94.4Very high47 Ų4781.3 Ų81.339%0.38840%0.397SS..Hα-helixtrans-62.6-44.8173.100000111.2L184 I185 Q186 R191 I192L184-A188 WeakPolarHBondContact O-CB 3.34Å; L184-A188 PolarHBondContact O-N 3.01Å; I185-A188 PolarHBondContact O-N 3.31Å; Q186-A188 PolarHBondContact O-N 2.87Å; A188-R191 PolarHBondContact O-N 3.04Å; A188-I192 WeakPolarHBondContact O-CD1 3.47Å; A188-I192 VanDerWaalsContact O-CG1 3.25Å; A188-I192 WeakPolarHBondContact O-CG1 3.47Å; A188-I192 PolarHBondContact O-N 3.44Å
189G96.6Very high92.4Very high3 Ų390.9 Ų90.93%0.03144%0.437CS..Hα-helixtrans-56.7-54.1175.400000112.7T133 I185 Q186 R191 I192 V193T133-G189 WeakPolarHBondContact OG1-CA 3.41Å; I185-G189 PolarHBondContact O-N 2.98Å; Q186-G189 PolarHBondContact O-N 3.39Å; Q186-G189 VanDerWaalsContact O-N 3.15Å; G189-R191 VanDerWaalsContact C-N 3.28Å; G189-R191 PolarHBondContact O-N 2.86Å; G189-I192 PolarHBondContact O-N 2.88Å; G189-V193 WeakPolarHBondContact O-CG2 3.48Å; G189-V193 PolarHBondContact O-N 3.05Å
190D96.2Very high92.1Very high61 Ų6192.1 Ų92.133%0.32644%0.439SS..Hα-helixtrans-59-39.4-179.7-66.1-17.1000112.1Q186 R194Q186-D190 PolarHBondContact NE2-OD1 3.22Å; Q186-D190 VanDerWaalsContact O-CG 3.26Å; Q186-D190 PolarHBondContact O-N 3.18Å; D190-R194 WeakPolarHBondContact O-CB 3.29Å; D190-R194 VanDerWaalsContact O-CG 3.26Å; D190-R194 WeakPolarHBondContact O-CG 3.5Å; D190-R194 PolarHBondContact O-N 3.09Å
191R95.9Very high91.8Very high156 Ų15692.4 Ų92.459%0.58944%0.439SS*.Hα-helixtrans-62.1-44174.6-77.4-109.2-176.590.6-12.2111.7F187 A188 G189 A195F187-R191 WeakPolarHBondContact O-CB 3.36Å; F187-R191 WeakPolarHBondContact O-CG 3.37Å; F187-R191 PolarHBondContact O-N 3.46Å; F187-R191 VanDerWaalsContact O-N 3.09Å; A188-R191 PolarHBondContact O-N 3.04Å; G189-R191 VanDerWaalsContact C-N 3.28Å; G189-R191 PolarHBondContact O-N 2.86Å; R191-A195 WeakPolarHBondContact O-CB 3.17Å; R191-A195 PolarHBondContact O-N 3.18Å
192I96Very high91.5Very high89 Ų8994.7 Ų94.746%0.45645%0.448SS..Hα-helixtrans-68-44.6179.2-62.8163000110.2V129 A188 G189 R194 A195 V196V129-I192 HydrophobicContact CB-CG2 4.41Å; V129-I192 HydrophobicContact CG1-CB 3.81Å; V129-I192 HydrophobicContact CG1-CG2 3.56Å; V129-I192 HydrophobicContact CG2-CG2 3.94Å; A188-I192 WeakPolarHBondContact O-CD1 3.47Å; A188-I192 VanDerWaalsContact O-CG1 3.25Å; A188-I192 WeakPolarHBondContact O-CG1 3.47Å; A188-I192 PolarHBondContact O-N 3.44Å; G189-I192 PolarHBondContact O-N 2.88Å; I192-R194 VanDerWaalsContact C-N 3.33Å; I192-R194 PolarHBondContact O-N 3.3Å; I192-A195 WeakPolarHBondContact O-CB 3.32Å; I192-A195 PolarHBondContact O-N 2.92Å; I192-A195 VanDerWaalsContact O-N 3.09Å; I192-V196 HydrophobicContact CG2-CG2 4.26Å; I192-V196 WeakPolarHBondContact O-CG2 3.34Å; I192-V196 PolarHBondContact O-N 3.47Å
193V94.9Very high91.1Very high30 Ų3097.8 Ų97.818%0.18246%0.459CS..Hα-helixtrans-54.8-50.8175.8173.60000110.2P126 V129 N130 G189 A195 V196 T197P126-V193 HydrophobicContact CB-CG1 4.26Å; V129-V193 HydrophobicContact CB-CG2 3.96Å; V129-V193 HydrophobicContact CG1-CG2 3.59Å; N130-V193 HydrophobicContact CB-CG2 4.39Å; G189-V193 WeakPolarHBondContact O-CG2 3.48Å; G189-V193 PolarHBondContact O-N 3.05Å; V193-A195 VanDerWaalsContact C-N 3.27Å; V193-A195 PolarHBondContact O-N 3.26Å; V193-V196 PolarHBondContact O-N 2.96Å; V193-V196 VanDerWaalsContact O-N 3.09Å; V193-T197 PolarHBondContact O-N 3.1Å; V193-T197 PolarHBondContact O-OG1 3.33Å
194R94.2Very high90.7Very high177 Ų17793.6 Ų93.667%0.66845%0.448SS*.Hα-helixtrans-60.1-35.1177.8-71.6174.6-173.1-1653.7113.3D190 I192 V196 R198D190-R194 WeakPolarHBondContact O-CB 3.29Å; D190-R194 VanDerWaalsContact O-CG 3.26Å; D190-R194 WeakPolarHBondContact O-CG 3.5Å; D190-R194 PolarHBondContact O-N 3.09Å; I192-R194 VanDerWaalsContact C-N 3.33Å; I192-R194 PolarHBondContact O-N 3.3Å; R194-V196 VanDerWaalsContact C-N 3.34Å; R194-R198 VanDerWaalsContact O-CG 3.27Å; R194-R198 WeakPolarHBondContact O-CG 3.18Å
195A93.1Very high90.2Very high66 Ų6692.8 Ų92.855%0.54544%0.441SS..Hα-helixtrans-71.4-31.3177.900000112.3R191 I192 V193R191-A195 WeakPolarHBondContact O-CB 3.17Å; R191-A195 PolarHBondContact O-N 3.18Å; I192-A195 WeakPolarHBondContact O-CB 3.32Å; I192-A195 PolarHBondContact O-N 2.92Å; I192-A195 VanDerWaalsContact O-N 3.09Å; V193-A195 VanDerWaalsContact C-N 3.27Å; V193-A195 PolarHBondContact O-N 3.26Å
196V91.9Very high89.7Confident33 Ų3398.6 Ų98.620%0.247%0.468CS..Hα-helixtrans-83.8-40.2-179.7175.70000112.1L125 P126 I192 V193 R194 R198L125-V196 HydrophobicContact CB-CG1 3.75Å; L125-V196 HydrophobicContact CD2-CG1 3.47Å; L125-V196 VanDerWaalsContact CD2-CG1 3.47Å; L125-V196 HydrophobicContact CD2-CG2 4.23Å; L125-V196 HydrophobicContact CG-CG1 3.56Å; L125-V196 HydrophobicContact CG-CG2 4.44Å; P126-V196 HydrophobicContact CG-CG1 4.01Å; I192-V196 HydrophobicContact CG2-CG2 4.26Å; I192-V196 WeakPolarHBondContact O-CG2 3.34Å; I192-V196 PolarHBondContact O-N 3.47Å; V193-V196 PolarHBondContact O-N 2.96Å; V193-V196 VanDerWaalsContact O-N 3.09Å; R194-V196 VanDerWaalsContact C-N 3.34Å; V196-R198 PolarHBondContact O-N 3.23Å
197T87.7Confident89Confident81 Ų81101.3 Ų101.350%0.49748%0.481SS..Hα-helixtrans-67.7-20.9179.1-530000113.2P126 V193 K199P126-T197 WeakPolarHBondContact CB-OG1 3.25Å; P126-T197 WeakPolarHBondContact CG-OG1 3.35Å; V193-T197 PolarHBondContact O-N 3.1Å; V193-T197 PolarHBondContact O-OG1 3.33Å; T197-K199 PolarHBondContact O-N 3.08Å; T197-K199 VanDerWaalsContact O-N 3.15Å
198R62Low88.3Confident221 Ų221100.7 Ų100.783%0.83448%0.481SS*.THydrogen-bonded Turntrans-80.422.6179.2-75.4-179.4177.6-158.6-1113.8R194 V196R194-R198 VanDerWaalsContact O-CG 3.27Å; R194-R198 WeakPolarHBondContact O-CG 3.18Å; V196-R198 PolarHBondContact O-N 3.23Å
199K53.5Low87.5Confident244 Ų244105.5 Ų105.5100%1.06149%0.49SS*.  trans-116.80171.5-69.2-172.3176.7-173.50108.7T197T197-K199 PolarHBondContact O-N 3.08Å; T197-K199 VanDerWaalsContact O-N 3.15Å

Retrieved 199 of 199 residues in 99.6 ms (Link to these results)

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